Basic information
- CAS
137641-36-2- Standard SMILES
CCCN(CCC)C1Cc2c[nH]c3ccc(C(N)=O)c(c23)C1.O=C(O)CNC(=O)c1ccccc1- InChIKey
WNHCMVMMLWRHHG-UHFFFAOYSA-N- Molecular formula
- C27H34N4O4
- Average molar mass
- 478.6 g/mol
- Monoisotopic mass
- 478.25800558
Names & identifiers
- Preferred name
- N-Benzoylglycine--4-(dipropylamino)-1,3,4,5-tetrahydrobenzo[cd]indole-6-carboxamide (1/1)
- IUPAC
- 2-benzamidoacetic acid;4-(dipropylamino)-1,3,4,5-tetrahydrobenzo[cd]indole-6-carboxamide
Names & synonyms
AC1Q5WNGSCHEMBL7512004DTXSID10275661N-Benzoylglycine--4-(dipropylamino)-1,3,4,5-tetrahydrobenzo[cd]indole-6-carboxamide (1/1)
Database identifiers
- CAS
137641-36-2- PubChem CID
- 60844
- DTXSID
DTXSID10275661
Properties
Computed structural properties
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 591
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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