N~3~-(butan-2-yl)-N~3~-[(4-methoxyphenyl)acetyl]-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-(butan-2-yl)-N~3~-[(4-methoxyphenyl)acetyl]-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide
N~3~-(butan-2-yl)-N~3~-[(4-methoxyphenyl)acetyl]-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide
Compound characteristics
| Compound ID: | V015-9311 |
| Compound Name: | N~3~-(butan-2-yl)-N~3~-[(4-methoxyphenyl)acetyl]-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide |
| Molecular Weight: | 482.6 |
| Molecular Formula: | C25 H30 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCC(C)N(CCC(Nc1nnc(c2cccc(c2)OC)s1)=O)C(Cc1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7984 |
| logD: | 4.7981 |
| logSw: | -4.5158 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.739 |
| InChI Key: | KYMRZHVLUAJIKE-KRWDZBQOSA-N |