3-[2-(4-benzylpiperazin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-[2-(4-benzylpiperazin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-[2-(4-benzylpiperazin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | D007-0030 |
| Compound Name: | 3-[2-(4-benzylpiperazin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 387.48 |
| Molecular Formula: | C23 H25 N5 O |
| Smiles: | C1CN(CCN1CCN1C=Nc2c3ccccc3[nH]c2C1=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.0147 |
| logD: | 1.8761 |
| logSw: | -2.5642 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.799 |
| InChI Key: | ISGIPRWERFAXQG-UHFFFAOYSA-N |