7-chloro-1-{[5-methyl-2-(thiophen-2-yl)-1,3-oxazol-4-yl]methyl}-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one
Chemical Structure Depiction of
7-chloro-1-{[5-methyl-2-(thiophen-2-yl)-1,3-oxazol-4-yl]methyl}-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one
7-chloro-1-{[5-methyl-2-(thiophen-2-yl)-1,3-oxazol-4-yl]methyl}-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one
Compound characteristics
| Compound ID: | E002-0953 |
| Compound Name: | 7-chloro-1-{[5-methyl-2-(thiophen-2-yl)-1,3-oxazol-4-yl]methyl}-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one |
| Molecular Weight: | 447.94 |
| Molecular Formula: | C24 H18 Cl N3 O2 S |
| Smiles: | Cc1c(CN2C(CN=C(c3ccccc3)c3cc(ccc23)[Cl])=O)nc(c2cccs2)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.7223 |
| logD: | 4.7223 |
| logSw: | -4.8251 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.082 |
| InChI Key: | BMUWKKLJRONWEO-UHFFFAOYSA-N |