1-{[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-phenyl-1,3,6,7,8,9-hexahydro-2H-[1]benzothieno[2,3-e][1,4]diazepin-2-one
Chemical Structure Depiction of
1-{[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-phenyl-1,3,6,7,8,9-hexahydro-2H-[1]benzothieno[2,3-e][1,4]diazepin-2-one
1-{[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-phenyl-1,3,6,7,8,9-hexahydro-2H-[1]benzothieno[2,3-e][1,4]diazepin-2-one
Compound characteristics
| Compound ID: | C798-0562 |
| Compound Name: | 1-{[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-phenyl-1,3,6,7,8,9-hexahydro-2H-[1]benzothieno[2,3-e][1,4]diazepin-2-one |
| Molecular Weight: | 502.03 |
| Molecular Formula: | C28 H24 Cl N3 O2 S |
| Smiles: | Cc1c(CN2C(CN=C(c3ccccc3)c3c4CCCCc4sc23)=O)nc(c2ccccc2[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 6.0045 |
| logD: | 6.0045 |
| logSw: | -5.9428 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.436 |
| InChI Key: | UMIDWMWKMFMJFK-UHFFFAOYSA-N |