2~4~-chloro-1~1~,3~1~-dimethyl-2~1~-(naphthalene-2-sulfonyl)-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole
Chemical Structure Depiction of
2~4~-chloro-1~1~,3~1~-dimethyl-2~1~-(naphthalene-2-sulfonyl)-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole
2~4~-chloro-1~1~,3~1~-dimethyl-2~1~-(naphthalene-2-sulfonyl)-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole
Compound characteristics
| Compound ID: | Y505-7140 |
| Compound Name: | 2~4~-chloro-1~1~,3~1~-dimethyl-2~1~-(naphthalene-2-sulfonyl)-1~1~H,2~1~H,3~1~H-1~4~,2~3~:2~5~,3~4~-terpyrazole |
| Molecular Weight: | 452.92 |
| Molecular Formula: | C21 H17 Cl N6 O2 S |
| Smiles: | Cn1cc(cn1)c1c(c(c2cnn(C)c2)n(n1)S(c1ccc2ccccc2c1)(=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9689 |
| logD: | 2.9689 |
| logSw: | -3.7551 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.885 |
| InChI Key: | DUUBRRLZSYWOBA-UHFFFAOYSA-N |