Basic information
- CAS
75144-38-6- Standard SMILES
O=C(NCCN1CCN2Cc3[nH]c4ccccc4c3CC2C1)c1ccc([N+](=O)[O-])cc1- InChIKey
NCPGPWRDYKZTCF-UHFFFAOYSA-N- Molecular formula
- C23H25N5O3
- Average molar mass
- 419.5 g/mol
- Monoisotopic mass
- 419.19573968
Names & identifiers
- Preferred name
- Benzamide, N-(2-(3,4,6,7,12,12a-hexahydropyrazino(1',2':1,6)pyrido(3,4-b)indol-2(1H)-yl)ethyl)-4-nitro-
- IUPAC
- 4-nitro-N-[2-(3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraen-6-yl)ethyl]benzamide
Names & synonyms
Benzamide, N-(2-(3,4,6,7,12,12a-hexahydropyrazino(1',2':1,6)pyrido(3,4-b)indol-2(1H)-yl)ethyl)-4-nitro-75144-38-6RefChem:1078048NSC600791BRN 46005444-nitro-N-(2-[?]ylethyl)benzamideNSC-600791N-[2-(3,4,6,7,12,12a-Hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-2(1H)-yl)ethyl]-4-nitrobenzamide
Database identifiers
- CAS
75144-38-6- PubChem CID
- 53173
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 97.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 662
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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