1-(2-{7-[(benzyloxy)acetyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl}piperidin-1-yl)propan-1-one
Chemical Structure Depiction of
1-(2-{7-[(benzyloxy)acetyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl}piperidin-1-yl)propan-1-one
1-(2-{7-[(benzyloxy)acetyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl}piperidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | S923-1030 |
| Compound Name: | 1-(2-{7-[(benzyloxy)acetyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl}piperidin-1-yl)propan-1-one |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C23 H31 N5 O3 |
| Smiles: | CCC(N1CCCCC1c1nnc2CCN(CCn12)C(COCc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1105 |
| logD: | 1.1105 |
| logSw: | -1.6696 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.712 |
| InChI Key: | ZKANXFYFCIULHZ-IBGZPJMESA-N |