![3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide structure](/static/products/5164/516458-84-7.webp)
3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide
TL;DR: 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide (CAS 516458-84-7) is a chemical compound with molecular formula C19H23N3S and molecular weight 325.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-anilinophenyl)-3-methylpiperidine-1-carbothioamide
Also Known As: 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide, N-(4-anilinophenyl)-3-methylpiperidine-1-carbothioamide, N-(4-anilinophenyl)-3-methyl-1-piperidinecarbothioamide
| Molecular Formula | C19H23N3S |
|---|---|
| Molecular Weight | 325.16 g/mol |
| LogP | 4.8589 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.16125 |
| Heavy Atoms | 23 |
| Complexity | 639.42413 |
Chemical Identifiers
| CAS Number | 516458-84-7 |
|---|---|
| SMILES | CC1CCCN(C1)C(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3 |
Product Overview
3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide (CAS 516458-84-7), with molecular formula C19H23N3S and molecular weight 325.16 g/mol. IUPAC: N-(4-anilinophenyl)-3-methylpiperidine-1-carbothioamide.
Chemical Property Profile of 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide
Property Insights of 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide
The XLogP value of 4.8589 indicates that 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.3 Ų, 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide has 2 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 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide?
The CAS number of 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide is 516458-84-7.
What is the molecular formula of 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide?
The molecular formula of 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide is C19H23N3S.
What is the molecular weight of 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide?
The molecular weight of 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide is 325.16 g/mol.
Where can I buy 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide?
You can request a quote for 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-N-[4-(phenylamino)phenyl]piperidine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.