3-[(6-chloro-1,3-benzothiazol-2-yl)amino]-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one
Chemical Structure Depiction of
3-[(6-chloro-1,3-benzothiazol-2-yl)amino]-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one
3-[(6-chloro-1,3-benzothiazol-2-yl)amino]-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one
Compound characteristics
| Compound ID: | 7616-0420 |
| Compound Name: | 3-[(6-chloro-1,3-benzothiazol-2-yl)amino]-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one |
| Molecular Weight: | 366.76 |
| Molecular Formula: | C15 H12 Cl N2 O3 P S |
| Smiles: | C1Oc2ccccc2OCP1(Nc1nc2ccc(cc2s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9984 |
| logD: | 3.9984 |
| logSw: | -4.4071 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.17 |
| InChI Key: | MAWYEQIVXZCLOT-UHFFFAOYSA-N |