benzyl 3-{2-[(cyclopropylmethyl)amino]-2-oxoethyl}-5-(2-fluorophenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 3-{2-[(cyclopropylmethyl)amino]-2-oxoethyl}-5-(2-fluorophenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 3-{2-[(cyclopropylmethyl)amino]-2-oxoethyl}-5-(2-fluorophenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V019-7013 |
| Compound Name: | benzyl 3-{2-[(cyclopropylmethyl)amino]-2-oxoethyl}-5-(2-fluorophenyl)-7-methyl-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(c2ccccc2F)N2C(CC(NCC3CC3)=O)=CSC2=N1)C(=O)OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5326 |
| logD: | 4.5325 |
| logSw: | -4.6388 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.237 |
| InChI Key: | PUDUJXWUXOAPAS-VWLOTQADSA-N |