2-(4-{4,7-dioxo-2-[(prop-2-yn-1-yl)sulfanyl]-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl}phenoxy)acetamide
Chemical Structure Depiction of
2-(4-{4,7-dioxo-2-[(prop-2-yn-1-yl)sulfanyl]-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl}phenoxy)acetamide
2-(4-{4,7-dioxo-2-[(prop-2-yn-1-yl)sulfanyl]-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl}phenoxy)acetamide
Compound characteristics
Compound ID: | D392-0390 |
Compound Name: | 2-(4-{4,7-dioxo-2-[(prop-2-yn-1-yl)sulfanyl]-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl}phenoxy)acetamide |
Molecular Weight: | 384.41 |
Molecular Formula: | C18 H16 N4 O4 S |
Smiles: | C#CCSC1NC(C2C(CC(NC=2N=1)=O)c1ccc(cc1)OCC(N)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | -0.2951 |
logD: | -0.3128 |
logSw: | -1.9942 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 99.027 |
InChI Key: | ZWSSAEMMIGVANY-GFCCVEGCSA-N |