chempirical

Pigment red 149

C40H26N2O4CAS 4948-15-6598.66 g/mol

Open in Covalent MOL file
NOOONO
AmideLactam

Properties

Molecular formula
C40H26N2O4
Molar mass
598.66 g/mol
Exact mass
598.1893 Da
Melting point
200–201 °C
logP
8.57Crippen estimate
Polar surface area
74.8 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
2

Identifiers

CAS number
4948-15-6
SMILES
Cc1cc(C)cc(N2C(=O)c3ccc4c5ccc6c7c(ccc(c8ccc(c3c48)C2=O)c75)C(=O)N(c2cc(C)cc(C)c2)C6=O)c1
InChIKey
FDXVHZCFTCIKDD-UHFFFAOYSA-N
InChI
InChI=1S/C40H26N2O4/c1-19-13-20(2)16-23(15-19)41-37(43)29-9-5-25-27-7-11-31-36-32(40(46)42(39(31)45)24-17-21(3)14-22(4)18-24)12-8-28(34(27)36)26-6-10-30(38(41)44)35(29)33(25)26/h5-18H,1-4H3

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Type any one amount. The others follow from the molar mass.

Names and synonyms

31 names · show all
  • Anthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-1,3,8,10(2H,9H)-tetrone, 2,9-bis(3,5-dimethylphenyl)-
  • 3,4,9,10-Perylenetetracarboxylic 3,4:9,10-diimide, N,N′-di-3,5-xylyl-
  • 2,9-Bis(3,5-dimethylphenyl)anthra[2,1,9-def:6,5,10-d'e'f′]diisoquinoline-1,3,8,10(2H,9H)-tetrone
  • N,N′-Bis(3′,5′-dimethylphenyl)perylene-3,4,9,10-dicarboimide
  • Perylene-3,4,9,10-tetracarboxylic acid bis(3′,5′-dimethylanilide)
  • N,N′-Bis(3,5-dimethylphenyl)perylene-3,4,9,10-tetracarboxylic 3,4:9,10-diimide
  • C.I. Pigment red 149
  • Permanent red BC
  • Permanent red BL
  • PV fast red B
  • Novoperm red BL
  • Kayaset red E-GR
  • Perylene PV fast red B
  • Paliogen red K 3580
  • PV solid red B
  • C.I. 71137
  • Lionogen red H 103B
  • N,N′-Bis(3,5-dimethylphenyl)-3,4:9,10-perylenebis(dicarboximide)
  • N,N′-Di(3,5-xylyl)perylene-3,4:9,10-bis(dicarboximide)
  • N,N′-Bis(3,5-dimethylphenyl)-3,4:9,10-perylenebis(dicarboxyimide)
  • N,N′-Bis(3,5-xylyl)perylene-3,4:9,10-bis(dicarboximide)
  • Dymic MBR 155
  • MBR 155
  • Red K 3580
  • PR 149 Red
  • PR 149
  • C.I. PR 149
  • Red 04
  • Exalite 613
  • Palamid red 35-8005
  • Dymic MBR 155 red

Work with Pigment red 149

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Pigment red 1906424-77-756 % similar Pigment red 1795521-31-353 % similar Pigment black 3283524-75-840 % similar Perylenetetracarboxylic dianhydride128-69-837 % similar N-Phenylphthalimide520-03-637 % similar N-(4-Methylphenyl)maleimide1631-28-334 % similar N,N,3,5-Tetramethylaniline4913-13-733 % similar 3,5-Dimethylbenzoyl chloride6613-44-133 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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