methyl 7-ethyl-5-(3-methoxyphenyl)-3-{2-[(3-methylbutyl)amino]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 7-ethyl-5-(3-methoxyphenyl)-3-{2-[(3-methylbutyl)amino]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 7-ethyl-5-(3-methoxyphenyl)-3-{2-[(3-methylbutyl)amino]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V012-2422 |
| Compound Name: | methyl 7-ethyl-5-(3-methoxyphenyl)-3-{2-[(3-methylbutyl)amino]-2-oxoethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 457.59 |
| Molecular Formula: | C24 H31 N3 O4 S |
| Smiles: | CCC1=C(C(c2cccc(c2)OC)N2C(CC(NCCC(C)C)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9521 |
| logD: | 3.9506 |
| logSw: | -4.0471 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.294 |
| InChI Key: | QRIAXVWFQMJWFB-QFIPXVFZSA-N |