Imipenem
Properties
- Molecular formula
- C12H17N3O4S
- Molar mass
- 299.35 g/mol
- Exact mass
- 299.0940 Da
- logP
- -0.18Crippen estimate
- Polar surface area
- 113.7 Ų
- H-bond donors / acceptors
- 4 / 5
- Rotatable bonds
- 7
- Stereocentres
- R, S, Rin SMILES atom order
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
64221-86-9SMILES
C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(SCCNC=N)C[C@H]12InChIKey
ZSKVGTPCRGIANV-ZXFLCMHBSA-NInChI
InChI=1S/C12H17N3O4S/c1-6(16)9-7-4-8(20-3-2-14-5-13)10(12(18)19)15(7)11(9)17/h5-7,9,16H,2-4H2,1H3,(H2,13,14)(H,18,19)/t6-,7-,9-/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
8 names
- 1-Azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 6-[(1R)-1-hydroxyethyl]-3-[[2-[(iminomethyl)amino]ethyl]thio]-7-oxo-, (5R,6S)-
- 1-Azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 6-(1-hydroxyethyl)-3-[[2-[(iminomethyl)amino]ethyl]thio]-7-oxo-, [5R-[5α,6α(R*)]]-
- (5R,6S)-6-[(1R)-1-Hydroxyethyl]-3-[[2-[(iminomethyl)amino]ethyl]thio]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
- MK 0787
- N-Formimidoylthienamycin
- Imipemide
- Tienamycin
- Imipenen
Work with Imipenem
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Thienamycin59995-64-168 % similar
Panipenem87726-17-851 % similar
Faropenem106560-14-939 % similar
(4-Nitrophenyl)methyl (5R,6S)-6-[(1R)-1-hydroxyethyl]-3-[[2-[[[[[(4-nitrophenyl)methoxy]carbonyl]amino]methylene]amino]ethyl]thio]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate98367-45-438 % similar
Tebipenem161715-21-536 % similar
Meropenem96036-03-235 % similar
Meropenem trihydrate119478-56-734 % similar
Doripenem148016-81-333 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.