8,9-dichloro-2,4-difluoro-1,3-bis{[3-(morpholin-4-yl)propyl]amino}-12H-benzimidazo[2,1-b][1,3]benzothiazin-12-one
Chemical Structure Depiction of
8,9-dichloro-2,4-difluoro-1,3-bis{[3-(morpholin-4-yl)propyl]amino}-12H-benzimidazo[2,1-b][1,3]benzothiazin-12-one
8,9-dichloro-2,4-difluoro-1,3-bis{[3-(morpholin-4-yl)propyl]amino}-12H-benzimidazo[2,1-b][1,3]benzothiazin-12-one
Compound characteristics
| Compound ID: | 8016-0488 |
| Compound Name: | 8,9-dichloro-2,4-difluoro-1,3-bis{[3-(morpholin-4-yl)propyl]amino}-12H-benzimidazo[2,1-b][1,3]benzothiazin-12-one |
| Molecular Weight: | 641.57 |
| Molecular Formula: | C28 H32 Cl2 F2 N6 O3 S |
| Smiles: | C(CNc1c2C(n3c4cc(c(cc4nc3Sc2c(c(c1F)NCCCN1CCOCC1)F)[Cl])[Cl])=O)CN1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.2717 |
| logD: | 3.1456 |
| logSw: | -3.9286 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.23 |
| InChI Key: | PFSXAEHKBWUZDG-UHFFFAOYSA-N |