1-(3-{5-[(3-chlorophenyl)methanesulfonyl]-1H-tetrazol-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(3-{5-[(3-chlorophenyl)methanesulfonyl]-1H-tetrazol-1-yl}phenyl)ethan-1-one
1-(3-{5-[(3-chlorophenyl)methanesulfonyl]-1H-tetrazol-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | 8017-4448 |
| Compound Name: | 1-(3-{5-[(3-chlorophenyl)methanesulfonyl]-1H-tetrazol-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 376.82 |
| Molecular Formula: | C16 H13 Cl N4 O3 S |
| Smiles: | CC(c1cccc(c1)n1c(nnn1)S(Cc1cccc(c1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5115 |
| logD: | 2.5115 |
| logSw: | -3.1871 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 83.123 |
| InChI Key: | VMFCIDSTIJTUES-UHFFFAOYSA-N |