1-[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]-4-phenylbutan-1-one
Chemical Structure Depiction of
1-[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]-4-phenylbutan-1-one
1-[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]-4-phenylbutan-1-one
Compound characteristics
| Compound ID: | T599-3587 |
| Compound Name: | 1-[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]-4-phenylbutan-1-one |
| Molecular Weight: | 372.48 |
| Molecular Formula: | C20 H24 N2 O3 S |
| Smiles: | CS(N1CCCN(C(CCCc2ccccc2)=O)c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3414 |
| logD: | 3.3414 |
| logSw: | -3.8298 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.351 |
| InChI Key: | NOUPMTHNKCOYCW-UHFFFAOYSA-N |