2-(4-chlorophenoxy)-1-(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenoxy)-1-(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)ethan-1-one
2-(4-chlorophenoxy)-1-(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | T599-3323 |
| Compound Name: | 2-(4-chlorophenoxy)-1-(5-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)ethan-1-one |
| Molecular Weight: | 330.81 |
| Molecular Formula: | C18 H19 Cl N2 O2 |
| Smiles: | CN1CCCN(C(COc2ccc(cc2)[Cl])=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.1296 |
| logD: | 3.1295 |
| logSw: | -3.4414 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.4829 |
| InChI Key: | IFXPMWKIYKAYCP-UHFFFAOYSA-N |