N-(3-chloro-4-fluorophenyl)-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-(3-chloro-4-fluorophenyl)-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-(3-chloro-4-fluorophenyl)-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: | L862-0816 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-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: | 465.93 |
| Molecular Formula: | C20 H21 Cl F N5 O3 S |
| Smiles: | CCN(CC)c1nc2c(C(N(CC=C)C(N2CC(Nc2ccc(c(c2)[Cl])F)=O)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.5086 |
| logD: | 4.5021 |
| logSw: | -4.5952 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.506 |
| InChI Key: | PSHNYDBPCSAYNP-UHFFFAOYSA-N |