TL;DR: 10Pr-SO-DBTA-11one (CAS 140412-81-3) is a chemical compound with molecular formula C16H15NO2S and molecular weight 285.08234 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
11-oxo-5-propylbenzo[b][1,4]benzothiazepin-6-one
Also Known As: 10Pr-SO-DBTA-11one, 10-Propyl-S-oxo-dibenz(b,f)(1,4)thiazepin-11-(10H)-one, 11-oxo-5-propylbenzo[b][1,4]benzothiazepin-6-one, 11-oxo-5-propyl-benzo[b][1,4]benzothiazepin-6-one, 10-Propyl-S-oxo-dibenz[b,f][1,4]thiazepin-11-(10H)-one
| Molecular Formula | C16H15NO2S |
| Molecular Weight | 285.08234 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 56.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.08234 Da |
| Heavy Atoms | 20 |
| Complexity | 398.0 |
| SMILES | CCCN1C2=CC=CC=C2S(=O)C3=CC=CC=C3C1=O |
| InChIKey | OQBYZFYPDHEJPK-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 10Pr-SO-DBTA-11one. With a topological polar surface area (TPSA) of 56.6 Ų, 10Pr-SO-DBTA-11one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10Pr-SO-DBTA-11one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 10Pr-SO-DBTA-11one is 140412-81-3.
The molecular formula of 10Pr-SO-DBTA-11one is C16H15NO2S.
The molecular weight of 10Pr-SO-DBTA-11one is 285.08234 g/mol.
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