[1-{bis[2-(hydroxy-kappaO)ethyl]amino-kappaN}-3-(3-chlorophenoxy)propan-2-olato(3-)-kappaO]boron
Chemical Structure Depiction of
[1-{bis[2-(hydroxy-kappaO)ethyl]amino-kappaN}-3-(3-chlorophenoxy)propan-2-olato(3-)-kappaO]boron
[1-{bis[2-(hydroxy-kappaO)ethyl]amino-kappaN}-3-(3-chlorophenoxy)propan-2-olato(3-)-kappaO]boron
Compound characteristics
| Compound ID: | 5491-0202 |
| Compound Name: | [1-{bis[2-(hydroxy-kappaO)ethyl]amino-kappaN}-3-(3-chlorophenoxy)propan-2-olato(3-)-kappaO]boron |
| Molecular Weight: | 297.54 |
| Molecular Formula: | C13 H17 B Cl N O4 |
| Smiles: | [B-]123[N+](CCO1)(CCO2)CC(COc1cccc(c1)[Cl])O3 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9533 |
| logD: | 1.9533 |
| logSw: | -2.4641 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.059 |
| InChI Key: | QNIQPUDUXXHGBZ-VQCLRJIVSA-N |