benzyl 3-{2-[(cyclopropylmethyl)amino]-2-oxoethyl}-5-(2,5-dimethylphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 3-{2-[(cyclopropylmethyl)amino]-2-oxoethyl}-5-(2,5-dimethylphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 3-{2-[(cyclopropylmethyl)amino]-2-oxoethyl}-5-(2,5-dimethylphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V019-6957 |
| Compound Name: | benzyl 3-{2-[(cyclopropylmethyl)amino]-2-oxoethyl}-5-(2,5-dimethylphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 501.65 |
| Molecular Formula: | C29 H31 N3 O3 S |
| Smiles: | CC1=C(C(c2cc(C)ccc2C)N2C(CC(NCC3CC3)=O)=CSC2=N1)C(=O)OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2932 |
| logD: | 5.2925 |
| logSw: | -5.3116 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.237 |
| InChI Key: | TWBWPCIBTCCOAL-HHHXNRCGSA-N |