ethyl 2,4-dimethyl-5-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamamido]-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2,4-dimethyl-5-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamamido]-1H-pyrrole-3-carboxylate
ethyl 2,4-dimethyl-5-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamamido]-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | D039-0094 |
| Compound Name: | ethyl 2,4-dimethyl-5-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamamido]-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 323.37 |
| Molecular Formula: | C13 H17 N5 O3 S |
| Smiles: | CCOC(c1c(C)c(NC(Nc2nnc(C)s2)=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9614 |
| logD: | 1.9602 |
| logSw: | -2.4096 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.497 |
| InChI Key: | APEJESRIJDTTLK-UHFFFAOYSA-N |