1-[1-(3-chlorobenzene-1-sulfonyl)pyrrolidin-3-yl]-3-methyl-5-(oxan-4-yl)-1H-1,2,4-triazole
Chemical Structure Depiction of
1-[1-(3-chlorobenzene-1-sulfonyl)pyrrolidin-3-yl]-3-methyl-5-(oxan-4-yl)-1H-1,2,4-triazole
1-[1-(3-chlorobenzene-1-sulfonyl)pyrrolidin-3-yl]-3-methyl-5-(oxan-4-yl)-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | CM3565-1501 |
| Compound Name: | 1-[1-(3-chlorobenzene-1-sulfonyl)pyrrolidin-3-yl]-3-methyl-5-(oxan-4-yl)-1H-1,2,4-triazole |
| Molecular Weight: | 410.92 |
| Molecular Formula: | C18 H23 Cl N4 O3 S |
| Smiles: | Cc1nc(C2CCOCC2)n(C2CCN(C2)S(c2cccc(c2)[Cl])(=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6012 |
| logD: | 2.5996 |
| logSw: | -3.1627 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.254 |
| InChI Key: | SAYOQRRTCUSCKY-MRXNPFEDSA-N |