di(propan-2-yl) {3,5-dichloro-1-[(4-methylbenzene-1-sulfonyl)amino]-4-oxocyclohexa-2,5-dien-1-yl}phosphonate
Chemical Structure Depiction of
di(propan-2-yl) {3,5-dichloro-1-[(4-methylbenzene-1-sulfonyl)amino]-4-oxocyclohexa-2,5-dien-1-yl}phosphonate
di(propan-2-yl) {3,5-dichloro-1-[(4-methylbenzene-1-sulfonyl)amino]-4-oxocyclohexa-2,5-dien-1-yl}phosphonate
Compound characteristics
| Compound ID: | 2704-0015 |
| Compound Name: | di(propan-2-yl) {3,5-dichloro-1-[(4-methylbenzene-1-sulfonyl)amino]-4-oxocyclohexa-2,5-dien-1-yl}phosphonate |
| Molecular Weight: | 496.35 |
| Molecular Formula: | C19 H24 Cl2 N O6 P S |
| Smiles: | CC(C)OP(C1(C=C(C(C(=C1)[Cl])=O)[Cl])NS(c1ccc(C)cc1)(=O)=O)(=O)OC(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.0755 |
| logD: | 4.075 |
| logSw: | -4.2594 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.524 |
| InChI Key: | QOPXJRMHNVUWPN-UHFFFAOYSA-N |