6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-3-chloro-11H-pyrido[2,1-b]quinazolin-11-one
Chemical Structure Depiction of
6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-3-chloro-11H-pyrido[2,1-b]quinazolin-11-one
6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-3-chloro-11H-pyrido[2,1-b]quinazolin-11-one
Compound characteristics
| Compound ID: | K306-0164 |
| Compound Name: | 6-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}-3-chloro-11H-pyrido[2,1-b]quinazolin-11-one |
| Molecular Weight: | 476.92 |
| Molecular Formula: | C25 H21 Cl N4 O4 |
| Smiles: | C1CN(CCN1Cc1ccc2c(c1)OCO2)C(C1=CC=CN2C1=Nc1cc(ccc1C2=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5147 |
| logD: | 2.2724 |
| logSw: | -3.3306 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.809 |
| InChI Key: | YURCZLFQWKXOMU-UHFFFAOYSA-N |