2-methoxy-1-{5-[(pyridin-3-yl)methyl]-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-methoxy-1-{5-[(pyridin-3-yl)methyl]-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl}ethan-1-one
2-methoxy-1-{5-[(pyridin-3-yl)methyl]-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | T599-0105 |
| Compound Name: | 2-methoxy-1-{5-[(pyridin-3-yl)methyl]-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl}ethan-1-one |
| Molecular Weight: | 311.38 |
| Molecular Formula: | C18 H21 N3 O2 |
| Smiles: | COCC(N1CCCN(Cc2cccnc2)c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4115 |
| logD: | 1.4093 |
| logSw: | -1.0301 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.21 |
| InChI Key: | HQIFDPJDZMTMNF-UHFFFAOYSA-N |