prop-2-en-1-yl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5-(2-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5-(2-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
prop-2-en-1-yl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5-(2-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V020-1046 |
| Compound Name: | prop-2-en-1-yl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-5-(2-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 507.58 |
| Molecular Formula: | C27 H26 F N3 O4 S |
| Smiles: | CC1=C(C(c2ccccc2OC)N2C(CC(NCc3ccc(cc3)F)=O)=CSC2=N1)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2015 |
| logD: | 4.2014 |
| logSw: | -4.451 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.535 |
| InChI Key: | YWHXIJCNMICYKJ-RUZDIDTESA-N |