2-chloro-5-(5-{[6-(ethoxycarbonyl)-7-methyl-5-(4-methylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}furan-2-yl)benzoic acid
Chemical Structure Depiction of
2-chloro-5-(5-{[6-(ethoxycarbonyl)-7-methyl-5-(4-methylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}furan-2-yl)benzoic acid
2-chloro-5-(5-{[6-(ethoxycarbonyl)-7-methyl-5-(4-methylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}furan-2-yl)benzoic acid
Compound characteristics
| Compound ID: | 3269-0188 |
| Compound Name: | 2-chloro-5-(5-{[6-(ethoxycarbonyl)-7-methyl-5-(4-methylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}furan-2-yl)benzoic acid |
| Molecular Weight: | 563.03 |
| Molecular Formula: | C29 H23 Cl N2 O6 S |
| Smiles: | CCOC(C1C(c2ccc(C)cc2)N2C(=NC=1C)SC(=C/c1ccc(c3ccc(c(c3)C(O)=O)[Cl])o1)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.432 |
| logD: | 2.0017 |
| logSw: | -5.8632 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.725 |
| InChI Key: | AUPLEZPUCGKMSD-VWLOTQADSA-N |