N-(4-ethoxyphenyl)-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
N-(4-ethoxyphenyl)-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | G681-0140 |
Compound Name: | N-(4-ethoxyphenyl)-2-{[4-(4-methylphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide |
Molecular Weight: | 443.57 |
Molecular Formula: | C26 H25 N3 O2 S |
Smiles: | CCOc1ccc(cc1)NC(CSC1CC(c2ccc(C)cc2)=Nc2ccccc2N=1)=O |
Stereo: | ACHIRAL |
logP: | 5.467 |
logD: | 5.4663 |
logSw: | -5.4375 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.463 |
InChI Key: | ZRMAOVJQTPZLKJ-UHFFFAOYSA-N |