2-[3-(butan-2-yl)-7-chloro-5-(2-chlorophenyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-[3-(butan-2-yl)-7-chloro-5-(2-chlorophenyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
2-[3-(butan-2-yl)-7-chloro-5-(2-chlorophenyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | K788-4179 |
| Compound Name: | 2-[3-(butan-2-yl)-7-chloro-5-(2-chlorophenyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-1-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide |
| Molecular Weight: | 526.51 |
| Molecular Formula: | C29 H33 Cl2 N3 O2 |
| Smiles: | CCC(C)C1C(N(CC(NCCC2CCCCC=2)=O)c2ccc(cc2C(c2ccccc2[Cl])=N1)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5403 |
| logD: | 5.5403 |
| logSw: | -5.659 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.727 |
| InChI Key: | SXPABKBDBGSNBV-UHFFFAOYSA-N |