2-({1-[2,5-diethoxy-4-(1H-tetrazol-1-yl)benzene-1-sulfonyl]piperidin-4-yl}sulfanyl)pyrimidine
Chemical Structure Depiction of
2-({1-[2,5-diethoxy-4-(1H-tetrazol-1-yl)benzene-1-sulfonyl]piperidin-4-yl}sulfanyl)pyrimidine
2-({1-[2,5-diethoxy-4-(1H-tetrazol-1-yl)benzene-1-sulfonyl]piperidin-4-yl}sulfanyl)pyrimidine
Compound characteristics
| Compound ID: | D283-0086 |
| Compound Name: | 2-({1-[2,5-diethoxy-4-(1H-tetrazol-1-yl)benzene-1-sulfonyl]piperidin-4-yl}sulfanyl)pyrimidine |
| Molecular Weight: | 491.59 |
| Molecular Formula: | C20 H25 N7 O4 S2 |
| Smiles: | CCOc1cc(c(cc1n1cnnn1)OCC)S(N1CCC(CC1)Sc1ncccn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6115 |
| logD: | 2.6115 |
| logSw: | -2.9022 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 103.72 |
| InChI Key: | XMAPGAWXDAAXMT-UHFFFAOYSA-N |