3-(3-chloro-4-fluoroanilino)-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one
Chemical Structure Depiction of
3-(3-chloro-4-fluoroanilino)-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one
3-(3-chloro-4-fluoroanilino)-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one
Compound characteristics
| Compound ID: | 8017-5373 |
| Compound Name: | 3-(3-chloro-4-fluoroanilino)-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one |
| Molecular Weight: | 327.68 |
| Molecular Formula: | C14 H12 Cl F N O3 P |
| Smiles: | C1Oc2ccccc2OCP1(Nc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2446 |
| logD: | 3.2446 |
| logSw: | -3.4115 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.409 |
| InChI Key: | ZXORHOTZYLWDTM-UHFFFAOYSA-N |