TL;DR: Sulfanilamide, N(sup 1)-(5-cyanopentyl)-, hydrochloride (CAS 63834-54-8) is a chemical compound with molecular formula C12H18ClN3O2S and molecular weight 303.0808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-N-(5-cyanopentyl)benzenesulfonamide;hydrochloride
Also Known As: USAF A-5907, epsilon-Sulfanilamidocapronitrile hydrochloride, Hexanenitrile, epsilon-sulfanilamide-, hydrochloride, Sulfanilamide, N(sup 1)-(5-cyanopentyl)-, hydrochloride, 4-amino-n-(5-cyanopentyl)benzenesulfonamide hydrochloride(1:1)
| Molecular Formula | C12H18ClN3O2S |
| Molecular Weight | 303.0808 g/mol |
| XLogP | 2.05 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 303.0808 Da |
| Heavy Atoms | 19 |
| Complexity | 372.0 |
| SMILES | C1=CC(=CC=C1N)S(=O)(=O)NCCCCCC#N.Cl |
| InChIKey | LOXDHMAVVKAGPK-UHFFFAOYSA-N |
The XLogP value of 2.05 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulfanilamide, N(sup 1)-(5-cyanopentyl)-, hydrochloride. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulfanilamide, N(sup 1)-(5-cyanopentyl)-, hydrochloride. Following Lipinski's Rule of Five, Sulfanilamide, N(sup 1)-(5-cyanopentyl)-, hydrochloride has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Sulfanilamide, N(sup 1)-(5-cyanopentyl)-, hydrochloride is 63834-54-8.
The molecular formula of Sulfanilamide, N(sup 1)-(5-cyanopentyl)-, hydrochloride is C12H18ClN3O2S.
The molecular weight of Sulfanilamide, N(sup 1)-(5-cyanopentyl)-, hydrochloride is 303.0808 g/mol.
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