(2,6-dichloro-4-{[6-(ethoxycarbonyl)-7-methyl-3-oxo-5-(3,4,5-trimethoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}phenoxy)acetic acid
Chemical Structure Depiction of
(2,6-dichloro-4-{[6-(ethoxycarbonyl)-7-methyl-3-oxo-5-(3,4,5-trimethoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}phenoxy)acetic acid
(2,6-dichloro-4-{[6-(ethoxycarbonyl)-7-methyl-3-oxo-5-(3,4,5-trimethoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}phenoxy)acetic acid
Compound characteristics
| Compound ID: | 3969-1014 |
| Compound Name: | (2,6-dichloro-4-{[6-(ethoxycarbonyl)-7-methyl-3-oxo-5-(3,4,5-trimethoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}phenoxy)acetic acid |
| Molecular Weight: | 637.49 |
| Molecular Formula: | C28 H26 Cl2 N2 O9 S |
| Smiles: | CCOC(C1C(c2cc(c(c(c2)OC)OC)OC)N2C(=NC=1C)SC(=C/c1cc(c(c(c1)[Cl])OCC(O)=O)[Cl])\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2017 |
| logD: | 0.9647 |
| logSw: | -5.3342 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.782 |
| InChI Key: | RAZOAMCZKZXOAB-QHCPKHFHSA-N |