[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl](3,4,5-trimethoxyphenyl)methanone
Chemical Structure Depiction of
[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl](3,4,5-trimethoxyphenyl)methanone
[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl](3,4,5-trimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | T599-3834 |
| Compound Name: | [5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl](3,4,5-trimethoxyphenyl)methanone |
| Molecular Weight: | 420.48 |
| Molecular Formula: | C20 H24 N2 O6 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(N1CCCN(c2ccccc12)S(C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8681 |
| logD: | 1.8681 |
| logSw: | -2.5924 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.856 |
| InChI Key: | YQDWDOVABWZHLP-UHFFFAOYSA-N |