methyl 5-carbamoyl-4-methyl-2-{[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carbonyl]amino}thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 5-carbamoyl-4-methyl-2-{[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carbonyl]amino}thiophene-3-carboxylate
methyl 5-carbamoyl-4-methyl-2-{[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carbonyl]amino}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y501-3208 |
| Compound Name: | methyl 5-carbamoyl-4-methyl-2-{[1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carbonyl]amino}thiophene-3-carboxylate |
| Molecular Weight: | 446.42 |
| Molecular Formula: | C16 H13 F3 N4 O4 S2 |
| Smiles: | Cc1c(C(=O)OC)c(NC(c2cc3c(C(F)(F)F)nn(C)c3s2)=O)sc1C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.097 |
| logD: | -0.2961 |
| logSw: | -2.8362 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.746 |
| InChI Key: | NIAHYWCGRIQKSS-UHFFFAOYSA-N |