N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-1,3,8-trimethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-1,3,8-trimethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-1,3,8-trimethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | F668-0833 |
| Compound Name: | N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-1,3,8-trimethyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide |
| Molecular Weight: | 486.96 |
| Molecular Formula: | C23 H27 Cl N6 O4 |
| Smiles: | CN1C2=C(C(=CC1=O)C(NCCN1CCN(CC1)c1cccc(c1)[Cl])=O)C(N(C)C(N2C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9107 |
| logD: | 0.7309 |
| logSw: | -2.5997 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.102 |
| InChI Key: | WTNVEGVYWYBUBG-UHFFFAOYSA-N |