N-(2-bromophenyl)-2-(butylsulfanyl)-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(2-bromophenyl)-2-(butylsulfanyl)-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
N-(2-bromophenyl)-2-(butylsulfanyl)-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | J023-0101 |
| Compound Name: | N-(2-bromophenyl)-2-(butylsulfanyl)-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide |
| Molecular Weight: | 451.34 |
| Molecular Formula: | C18 H19 Br N4 O3 S |
| Smiles: | CCCCSC1NC(C2C(CC(NC=2N=1)=O)C(Nc1ccccc1[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4922 |
| logD: | 2.4785 |
| logSw: | -2.8489 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.805 |
| InChI Key: | GMHVKDXDYWTBCG-SNVBAGLBSA-N |