3-methyl-1-(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)butan-1-one
Chemical Structure Depiction of
3-methyl-1-(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)butan-1-one
3-methyl-1-(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)butan-1-one
Compound characteristics
| Compound ID: | T599-3046 |
| Compound Name: | 3-methyl-1-(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)butan-1-one |
| Molecular Weight: | 246.35 |
| Molecular Formula: | C15 H22 N2 O |
| Smiles: | CC(C)CC(N1CCCN(C)c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5799 |
| logD: | 2.5797 |
| logSw: | -2.7324 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 18.2553 |
| InChI Key: | ZVFZBYIIUJYSSZ-UHFFFAOYSA-N |