1-(5-bromothiophene-2-sulfonyl)-4-[3-(methoxymethyl)-4H-1,2,4-triazol-4-yl]piperidine
Chemical Structure Depiction of
1-(5-bromothiophene-2-sulfonyl)-4-[3-(methoxymethyl)-4H-1,2,4-triazol-4-yl]piperidine
1-(5-bromothiophene-2-sulfonyl)-4-[3-(methoxymethyl)-4H-1,2,4-triazol-4-yl]piperidine
Compound characteristics
| Compound ID: | P939-5082 |
| Compound Name: | 1-(5-bromothiophene-2-sulfonyl)-4-[3-(methoxymethyl)-4H-1,2,4-triazol-4-yl]piperidine |
| Molecular Weight: | 421.33 |
| Molecular Formula: | C13 H17 Br N4 O3 S2 |
| Smiles: | COCc1nncn1C1CCN(CC1)S(c1ccc(s1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6779 |
| logD: | 1.6779 |
| logSw: | -2.2475 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.824 |
| InChI Key: | ZZNWSADCQSLYNO-UHFFFAOYSA-N |