N-(2,6-dimethylphenyl)-2-{[4-(3-methoxyphenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-2-{[4-(3-methoxyphenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
N-(2,6-dimethylphenyl)-2-{[4-(3-methoxyphenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | L389-0634 |
| Compound Name: | N-(2,6-dimethylphenyl)-2-{[4-(3-methoxyphenyl)-7,8-dimethyl-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 471.62 |
| Molecular Formula: | C28 H29 N3 O2 S |
| Smiles: | Cc1cc2c(cc1C)N=C(CC(c1cccc(c1)OC)=N2)SCC(Nc1c(C)cccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8484 |
| logD: | 5.8425 |
| logSw: | -5.5201 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.487 |
| InChI Key: | AQXFYJPLVFRCDD-UHFFFAOYSA-N |