![3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide structure](/static/products/3352/335213-72-4.webp)
3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide
TL;DR: 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide (CAS 335213-72-4) is a chemical compound with molecular formula C21H25N3O3S and molecular weight 399.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dimethoxy-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide
Also Known As: BAS 02818672, 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide, 3,4-dimethoxy-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide, 1-(3,4-Dimethoxy-benzoyl)-3-(4-piperidin-1-yl-phenyl)-thiourea, N-(3,4-dimethoxybenzoyl)-N'-[4-(1-piperidinyl)phenyl]thiourea
| Molecular Formula | C21H25N3O3S |
|---|---|
| Molecular Weight | 399.16 g/mol |
| LogP | 3.8209 |
| Topological Polar Surface Area | 62.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.16165 |
| Heavy Atoms | 28 |
| Complexity | 833.2895 |
Chemical Identifiers
| CAS Number | 335213-72-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3)OC |
Product Overview
3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide (CAS 335213-72-4), with molecular formula C21H25N3O3S and molecular weight 399.16 g/mol. IUPAC: 3,4-dimethoxy-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide.
Chemical Property Profile of 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide
Property Insights of 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide
The XLogP value of 3.8209 indicates that 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide. Following Lipinski's Rule of Five, 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide has 2 hydrogen bond donor(s) and 5 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 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide?
The CAS number of 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide is 335213-72-4.
What is the molecular formula of 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide?
The molecular formula of 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide is C21H25N3O3S.
What is the molecular weight of 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide?
The molecular weight of 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide is 399.16 g/mol.
Where can I buy 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide?
You can request a quote for 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dimethoxy-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.