chempirical

Fosinopril

C30H46NO7PCAS 98048-97-6563.67 g/mol

Open in Covalent MOL file
OOOPOONOOH
AmideCarboxylic acidEster

Properties

Molecular formula
C30H46NO7P
Molar mass
563.67 g/mol
Exact mass
563.3012 Da
logP
6.12Crippen estimate
Polar surface area
110.2 Ų
H-bond donors / acceptors
1 / 6
Rotatable bonds
14
Stereocentres
S, R, S, Sin SMILES atom order

Identifiers

CAS number
98048-97-6
SMILES
CCC(=O)O[C@@H](O[P@](=O)(CCCCc1ccccc1)CC(=O)N1C[C@H](C2CCCCC2)C[C@H]1C(=O)O)C(C)C
InChIKey
BIDNLKIUORFRQP-XYGFDPSESA-N
InChI
InChI=1S/C30H46NO7P/c1-4-28(33)37-30(22(2)3)38-39(36,18-12-11-15-23-13-7-5-8-14-23)21-27(32)31-20-25(19-26(31)29(34)35)24-16-9-6-10-17-24/h5,7-8,13-14,22,24-26,30H,4,6,9-12,15-21H2,1-3H3,(H,34,35)/t25-,26+,30+,39-/m1/s1

Weigh it out

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

Names and synonyms

6 names
  • L-Proline, 4-cyclohexyl-1-[2-[(R)-[(1S)-2-methyl-1-(1-oxopropoxy)propoxy](4-phenylbutyl)phosphinyl]acetyl]-, (4S)-
  • L-Proline, 4-cyclohexyl-1-[[[2-methyl-1-(1-oxopropoxy)propoxy](4-phenylbutyl)phosphinyl]acetyl]-, [1[S*(R*)],2α,4β]-
  • L-Proline, 4-cyclohexyl-1-[[(R)-[(1S)-2-methyl-1-(1-oxopropoxy)propoxy](4-phenylbutyl)phosphinyl]acetyl]-, (4S)-
  • (4S)-4-Cyclohexyl-1-[2-[(R)-[(1S)-2-methyl-1-(1-oxopropoxy)propoxy](4-phenylbutyl)phosphinyl]acetyl]-L-proline
  • Fosenopril
  • Fozitec

Work with Fosinopril

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

Fosinopril sodium88889-14-978 % similar 2-[[2-Methyl-1-(1-oxopropoxy)propoxy](4-phenylbutyl)phosphinyl]acetic acid123599-78-062 % similar Sepilift dphp41672-81-533 % similar Trandolapril87679-37-633 % similar Ramiprilat87269-97-432 % similar Ramipril87333-19-532 % similar Boc-D-N-me-phe DCHA102185-45-531 % similar (αS)-α-[[(Phenylmethoxy)carbonyl]amino]cyclohexaneacetic acid69901-75-331 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook