8-chloro-3-[3-(pyrrolidin-1-yl)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
8-chloro-3-[3-(pyrrolidin-1-yl)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
8-chloro-3-[3-(pyrrolidin-1-yl)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | D007-0374 |
| Compound Name: | 8-chloro-3-[3-(pyrrolidin-1-yl)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 330.82 |
| Molecular Formula: | C17 H19 Cl N4 O |
| Smiles: | C1CCN(C1)CCCN1C=Nc2c3cc(ccc3[nH]c2C1=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.173 |
| logD: | -0.3584 |
| logSw: | -3.2176 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.624 |
| InChI Key: | VLAHPBNSHUZCMJ-UHFFFAOYSA-N |