chempirical

Delpazolid

C14H17FN4O3CAS 1219707-39-7308.31 g/mol

Open in Covalent MOL file
NNNNOOOHF
AlcoholAryl halideCarbamateHydrazoneTertiary amine

Properties

Molecular formula
C14H17FN4O3
Molar mass
308.31 g/mol
Exact mass
308.1285 Da
logP
0.84Crippen estimate
Polar surface area
68.6 Ų
H-bond donors / acceptors
1 / 6
Rotatable bonds
3
Stereocentres
Rin SMILES atom order

Identifiers

CAS number
1219707-39-7
SMILES
CN1CCN(C=N1)C2=C(C=C(C=C2)N3C[C@@H](OC3=O)CO)F
InChIKey
QLUWQAFDTNAYPN-LLVKDONJSA-N
InChI
InChI=1S/C14H17FN4O3/c1-17-4-5-18(9-16-17)13-3-2-10(6-12(13)15)19-7-11(8-20)22-14(19)21/h2-3,6,9,11,20H,4-5,7-8H2,1H3/t11-/m1/s1

Weigh it out

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

Work with Delpazolid

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

Linezolid165800-03-351 % similar (5R)-5-(Azidomethyl)-3-[3-fluoro-4-(4-morpholinyl)phenyl]-2-oxazolidinone168828-84-048 % similar Tedizolid856866-72-343 % similar 4-[4-[(5S)-5-(Aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]-morpholin-3-one446292-10-033 % similar Tedizolid phosphate856867-55-533 % similar 4-[4-[(5S)-5-(Aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholin-3-one hydrochloride898543-06-132 % similar 2-[[(5S)-2-Oxo-3-[4-(3-oxo-4-morpholinyl)phenyl]-5-oxazolidinyl]methyl]-1H-isoindole-1,3(2H)-dione446292-08-631 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook