2-chloro-5-(5-{[5-(2,7-dimethoxynaphthalen-1-yl)-6-(ethoxycarbonyl)-7-methyl-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-{[5-(2,7-dimethoxynaphthalen-1-yl)-6-(ethoxycarbonyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}furan-2-yl)benzoic acid
2-chloro-5-(5-{[5-(2,7-dimethoxynaphthalen-1-yl)-6-(ethoxycarbonyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}furan-2-yl)benzoic acid
Compound characteristics
Compound ID: | 3184-1216 |
Compound Name: | 2-chloro-5-(5-{[5-(2,7-dimethoxynaphthalen-1-yl)-6-(ethoxycarbonyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}furan-2-yl)benzoic acid |
Molecular Weight: | 659.11 |
Molecular Formula: | C34 H27 Cl N2 O8 S |
Smiles: | CCOC(C1C(c2c(ccc3ccc(cc23)OC)OC)N2C(=NC=1C)SC(=C/c1ccc(c3ccc(c(c3)C(O)=O)[Cl])o1)\C2=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 7.2332 |
logD: | 2.8029 |
logSw: | -6.1963 |
Hydrogen bond acceptors count: | 13 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 96.628 |
InChI Key: | RZNSKECKJHBFLP-PMERELPUSA-N |