N-(4-bromophenyl)-2-[(2-ethyl-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-[(2-ethyl-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]acetamide
N-(4-bromophenyl)-2-[(2-ethyl-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | G786-1685 |
Compound Name: | N-(4-bromophenyl)-2-[(2-ethyl-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl)sulfanyl]acetamide |
Molecular Weight: | 464.34 |
Molecular Formula: | C18 H18 Br N5 O3 S |
Smiles: | CCc1nc2c(C(N(C)C(N2C)=O)=O)c(n1)SCC(Nc1ccc(cc1)[Br])=O |
Stereo: | ACHIRAL |
logP: | 3.7119 |
logD: | 3.7118 |
logSw: | -4.1654 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.195 |
InChI Key: | ZUWRZJVIJQZBOL-UHFFFAOYSA-N |