1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride
TL;DR: 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride (CAS 19481-73-3) is a chemical compound with molecular formula C16H26ClN3S and molecular weight 327.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-3-(N-methylanilino)pyrrolidine-1-carbothioamide;hydrochloride
Also Known As: N-Butyl-3-(N-methylanilino)thio-1-pyrrolidinecarboxamide hydrochloride, 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride, N-butyl-3-(N-methylanilino)pyrrolidine-1-carbothioamide hydrochloride, N-Butyl-3-[methyl(phenyl)amino]pyrrolidine-1-carboximidothioic acid--hydrogen chloride (1/1), RefChem:235208
| Molecular Formula | C16H26ClN3S |
|---|---|
| Molecular Weight | 327.15 g/mol |
| LogP | 3.2935 |
| Topological Polar Surface Area | 18.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.1536 |
| Heavy Atoms | 21 |
| Complexity | 426.79007 |
Chemical Identifiers
| CAS Number | 19481-73-3 |
|---|---|
| SMILES | CCCCNC(=S)N1CCC(C1)N(C)C2=CC=CC=C2.Cl |
Product Overview
1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride (CAS 19481-73-3), with molecular formula C16H26ClN3S and molecular weight 327.15 g/mol. IUPAC: N-butyl-3-(N-methylanilino)pyrrolidine-1-carbothioamide;hydrochloride.
Chemical Property Profile of 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride
Property Insights of 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride
The XLogP value of 3.2935 indicates that 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.51 Ų, 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride?
The CAS number of 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride is 19481-73-3.
What is the molecular formula of 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride?
The molecular formula of 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride is C16H26ClN3S.
What is the molecular weight of 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride?
The molecular weight of 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride is 327.15 g/mol.
Where can I buy 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride?
You can request a quote for 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyrrolidinecarboxamide, N-butyl-3-(N-methylanilino)thio-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.