[4-({[4-(2-methoxyethyl)-5-(2-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone
Chemical Structure Depiction of
[4-({[4-(2-methoxyethyl)-5-(2-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone
[4-({[4-(2-methoxyethyl)-5-(2-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone
Compound characteristics
Compound ID: | V025-8847 |
Compound Name: | [4-({[4-(2-methoxyethyl)-5-(2-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](morpholin-4-yl)methanone |
Molecular Weight: | 483.55 |
Molecular Formula: | C23 H25 N5 O5 S |
Salt: | not_available |
Smiles: | COCCn1c(c2ccccc2[N+]([O-])=O)nnc1SCc1ccc(cc1)C(N1CCOCC1)=O |
Stereo: | ACHIRAL |
logP: | 1.8582 |
logD: | 1.8582 |
logSw: | -2.4796 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 90.199 |
InChI Key: | QCYXDLBWBJTGMO-UHFFFAOYSA-N |