2-[(4-{4-[(pyrimidin-2-yl)amino]butanoyl}piperazin-1-yl)methyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[(4-{4-[(pyrimidin-2-yl)amino]butanoyl}piperazin-1-yl)methyl]quinazolin-4(3H)-one
2-[(4-{4-[(pyrimidin-2-yl)amino]butanoyl}piperazin-1-yl)methyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y041-8118 |
| Compound Name: | 2-[(4-{4-[(pyrimidin-2-yl)amino]butanoyl}piperazin-1-yl)methyl]quinazolin-4(3H)-one |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C21 H25 N7 O2 |
| Smiles: | C(CC(N1CCN(CC1)CC1NC(c2ccccc2N=1)=O)=O)CNc1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | -0.5989 |
| logD: | -0.6018 |
| logSw: | -2.2833 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.751 |
| InChI Key: | KUPMLRDXZDQNHX-UHFFFAOYSA-N |