5-[(4-phenylpiperazin-1-yl)methyl]-1,5-dihydro-6H-[1,2]diazepino[4,5,6-cd]indol-6-one
Chemical Structure Depiction of
5-[(4-phenylpiperazin-1-yl)methyl]-1,5-dihydro-6H-[1,2]diazepino[4,5,6-cd]indol-6-one
5-[(4-phenylpiperazin-1-yl)methyl]-1,5-dihydro-6H-[1,2]diazepino[4,5,6-cd]indol-6-one
Compound characteristics
| Compound ID: | Y043-3154 |
| Compound Name: | 5-[(4-phenylpiperazin-1-yl)methyl]-1,5-dihydro-6H-[1,2]diazepino[4,5,6-cd]indol-6-one |
| Molecular Weight: | 359.43 |
| Molecular Formula: | C21 H21 N5 O |
| Smiles: | C1CN(CCN1CN1C(c2cccc3c2c(C=N1)c[nH]3)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6526 |
| logD: | 2.6521 |
| logSw: | -3.3485 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.118 |
| InChI Key: | QNBSXSKBBWBQBV-UHFFFAOYSA-N |