TL;DR: 1,3,2-Dithiaphospholane, 2-(dibutylamino)- (CAS 73987-22-1) is a chemical compound with molecular formula C10H22NPS2 and molecular weight 251.09312 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-dibutyl-1,3,2-dithiaphospholan-2-amine
Also Known As: 1,3,2-DITHIAPHOSPHOLANE, 2-(DIBUTYLAMINO)-, N,N-dibutyl-1,3,2-dithiaphospholan-2-amine, 2-(N,N-Dibutylamino)-1,3,2-dithiaphospholane, 2-(Dibutylamino)-1,3,2-dithiaphospholane, 1,3,2-Dithiaphospholan-2-amine, N,N-dibutyl-
| Molecular Formula | C10H22NPS2 |
| Molecular Weight | 251.09312 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 53.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 251.09312 Da |
| Heavy Atoms | 14 |
| Complexity | 132.0 |
| SMILES | CCCCN(CCCC)P1SCCS1 |
| InChIKey | QIUMVPDZHZJKCG-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that 1,3,2-Dithiaphospholane, 2-(dibutylamino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.8 Ų, 1,3,2-Dithiaphospholane, 2-(dibutylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,2-Dithiaphospholane, 2-(dibutylamino)- 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 1,3,2-Dithiaphospholane, 2-(dibutylamino)- is 73987-22-1.
The molecular formula of 1,3,2-Dithiaphospholane, 2-(dibutylamino)- is C10H22NPS2.
The molecular weight of 1,3,2-Dithiaphospholane, 2-(dibutylamino)- is 251.09312 g/mol.
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