butyl 4-[(3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonyl)amino]benzoate
Chemical Structure Depiction of
butyl 4-[(3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonyl)amino]benzoate
butyl 4-[(3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonyl)amino]benzoate
Compound characteristics
| Compound ID: | C301-5305 |
| Compound Name: | butyl 4-[(3,7-dimethyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-sulfonyl)amino]benzoate |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C19 H21 N3 O5 S2 |
| Smiles: | CCCCOC(c1ccc(cc1)NS(C1=C(C)N=C2N(C(C)=CS2)C1=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3545 |
| logD: | 1.2709 |
| logSw: | -3.509 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.467 |
| InChI Key: | YTNOCZGHTUVCFM-UHFFFAOYSA-N |