methyl 4-[(2,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(2,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonyl)amino]benzoate
methyl 4-[(2,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonyl)amino]benzoate
Compound characteristics
| Compound ID: | E559-0605 |
| Compound Name: | methyl 4-[(2,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonyl)amino]benzoate |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C16 H15 N3 O5 S2 |
| Smiles: | CC1=CN2C(=NC(C)=C(C2=O)S(Nc2ccc(cc2)C(=O)OC)(=O)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 1.8073 |
| logD: | -0.2762 |
| logSw: | -2.5417 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.447 |
| InChI Key: | NTFPSCPPLURBCA-UHFFFAOYSA-N |