prop-2-en-1-yl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-(3-methylphenyl)-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)-7-methyl-5-(3-methylphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
prop-2-en-1-yl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-(3-methylphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V024-9999 |
| Compound Name: | prop-2-en-1-yl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-(3-methylphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 491.58 |
| Molecular Formula: | C27 H26 F N3 O3 S |
| Smiles: | CC1=C(C(c2cccc(C)c2)N2C(CC(NCc3ccc(cc3)F)=O)=CSC2=N1)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6082 |
| logD: | 4.608 |
| logSw: | -4.4857 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.904 |
| InChI Key: | DENXJRKNWPKAID-VWLOTQADSA-N |