Basic information
- Standard SMILES
CC(C)N(C(=O)CN1C(=O)C(CC=Cc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1- InChIKey
MDNFYUYRWYOVTL-UHFFFAOYSA-N- Molecular formula
- C35H33N3O3
- Average molar mass
- 543.7 g/mol
Names & identifiers
- Preferred name
- 2-[2,4-Dioxo-5-phenyl-3-(3-phenyl-allyl)-2,3,4,5-tetrahydro-benzo[b][1,4]diazepin-1-yl]-N-isopropyl-N-phenyl acetamide
- IUPAC
- 2-[2,4-dioxo-5-phenyl-3-(3-phenylprop-2-enyl)-1,5-benzodiazepin-1-yl]-N-phenyl-N-propan-2-ylacetamide
Names & synonyms
SCHEMBL8809199MDNFYUYRWYOVTL-UHFFFAOYSA-N2-[2,4-Dioxo-5-phenyl-3-(3-phenyl-allyl)-2,3,4,5-tetrahydro-benzo[b][1,4]diazepin-1-yl]-N-isopropyl-N-phenyl acetamide2-[2,4-Dioxo-5-phenyl-3-(3-phenyl-allyl)-2,3,4,5-tetrahydrobenzo[b][1,4]diazepin-1-yl]-N-isopropyl-N-phenyl acetamide
Database identifiers
- PubChem CID
- 67698157
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 60.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 914
Related reactions
2 records
Compound notes
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