N-(2-chloro-4-methylphenyl)-2-[2-(diethylamino)-5,7-dioxo-6-(prop-2-en-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]acetamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-[2-(diethylamino)-5,7-dioxo-6-(prop-2-en-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]acetamide
N-(2-chloro-4-methylphenyl)-2-[2-(diethylamino)-5,7-dioxo-6-(prop-2-en-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]acetamide
Compound characteristics
| Compound ID: | L862-0777 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-[2-(diethylamino)-5,7-dioxo-6-(prop-2-en-1-yl)-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-4(5H)-yl]acetamide |
| Molecular Weight: | 461.97 |
| Molecular Formula: | C21 H24 Cl N5 O3 S |
| Smiles: | CCN(CC)c1nc2c(C(N(CC=C)C(N2CC(Nc2ccc(C)cc2[Cl])=O)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.5023 |
| logD: | 4.5021 |
| logSw: | -4.5021 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.808 |
| InChI Key: | IPSDHQTWEXGNQR-UHFFFAOYSA-N |