[(4R,6R,7S,8R)-7-methoxy-12-methyl-10,13-dioxo-11-pyrrolidin-1-yl-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate
Basic information
- CAS
4349-74-0- Standard SMILES
CO[C@@]12[C@@H]3N[C@@H]3CN1C1=C(C(=O)C(N3CCCC3)=C(C)C1=O)[C@@H]2COC(N)=O- InChIKey
IWUUZLDYISMSIM-WPTVWNQNSA-N- Molecular formula
- C19H24N4O5
- Average molar mass
- 388.4 g/mol
- Monoisotopic mass
- 388.17466988
Names & identifiers
- Preferred name
- [(4R,6R,7S,8R)-7-methoxy-12-methyl-10,13-dioxo-11-pyrrolidin-1-yl-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate
- IUPAC
- [(4R,6R,7S,8R)-7-methoxy-12-methyl-10,13-dioxo-11-pyrrolidin-1-yl-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate
Names & synonyms
NSC365354NSC-365354Azirino[2',4]pyrrolo[1,2-a]indole-4,7-dione, 8-[[(aminocarbonyl)oxy]methyl]-1,1a,2,8,8a,8b-hexahydro-8a- methoxy-5-methyl-6-(1-pyrrolidinyl)-, [1aR-(1a.alpha.,8.beta.,8a.alpha.,8b.alpha.)]-
Database identifiers
- CAS
4349-74-0- PubChem CID
- 339291
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 858
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Compound notes
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