[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]{4-[(propan-2-yl)oxy]phenyl}methanone
Chemical Structure Depiction of
[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]{4-[(propan-2-yl)oxy]phenyl}methanone
[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]{4-[(propan-2-yl)oxy]phenyl}methanone
Compound characteristics
| Compound ID: | T599-3560 |
| Compound Name: | [5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]{4-[(propan-2-yl)oxy]phenyl}methanone |
| Molecular Weight: | 388.48 |
| Molecular Formula: | C20 H24 N2 O4 S |
| Smiles: | CC(C)Oc1ccc(cc1)C(N1CCCN(c2ccccc12)S(C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8196 |
| logD: | 2.8196 |
| logSw: | -3.4655 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.681 |
| InChI Key: | FWZZOUXPFLNQIK-UHFFFAOYSA-N |