2,4-dichloro-N-[2-(4-methoxyphenyl)-4-(pyrrolidine-1-carbonyl)-1,2,3-thiadiazol-5(2H)-ylidene]benzamide
Chemical Structure Depiction of
2,4-dichloro-N-[2-(4-methoxyphenyl)-4-(pyrrolidine-1-carbonyl)-1,2,3-thiadiazol-5(2H)-ylidene]benzamide
2,4-dichloro-N-[2-(4-methoxyphenyl)-4-(pyrrolidine-1-carbonyl)-1,2,3-thiadiazol-5(2H)-ylidene]benzamide
Compound characteristics
| Compound ID: | Y010-2017 |
| Compound Name: | 2,4-dichloro-N-[2-(4-methoxyphenyl)-4-(pyrrolidine-1-carbonyl)-1,2,3-thiadiazol-5(2H)-ylidene]benzamide |
| Molecular Weight: | 477.37 |
| Molecular Formula: | C21 H18 Cl2 N4 O3 S |
| Smiles: | COc1ccc(cc1)N1N=C(/C(=N/C(c2ccc(cc2[Cl])[Cl])=O)S1)C(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.226 |
| logD: | 4.2258 |
| logSw: | -4.654 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.89 |
| InChI Key: | RNNGFPIYIKPXRR-UHFFFAOYSA-N |