ethyl N-[({5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}methyl)carbamoyl]-beta-alaninate
Chemical Structure Depiction of
ethyl N-[({5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}methyl)carbamoyl]-beta-alaninate
ethyl N-[({5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}methyl)carbamoyl]-beta-alaninate
Compound characteristics
| Compound ID: | L062-0460 |
| Compound Name: | ethyl N-[({5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}methyl)carbamoyl]-beta-alaninate |
| Molecular Weight: | 407.45 |
| Molecular Formula: | C17 H21 N5 O5 S |
| Smiles: | CCOC(CCNC(NCc1nnc(C(Nc2ccc(cc2)OC)=O)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.961 |
| logD: | 0.9609 |
| logSw: | -2.2171 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 110.092 |
| InChI Key: | MTWNKDVFEDTEKR-UHFFFAOYSA-N |