N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea
TL;DR: N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea (CAS 335214-59-0) is a chemical compound with molecular formula C14H12BrN3O2S and molecular weight 364.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-4-methoxy-N-(pyridin-3-ylcarbamothioyl)benzamide
Also Known As: BAS 02819360, N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea, 3-bromo-4-methoxy-N-(pyridin-3-ylcarbamothioyl)benzamide, 1-(3-Bromo-4-methoxy-benzoyl)-3-pyridin-3-yl-thiourea, (3-bromo-4-methoxyphenyl)-N-[(3-pyridylamino)thioxomethyl]carboxamide
| Molecular Formula | C14H12BrN3O2S |
|---|---|
| Molecular Weight | 364.98 g/mol |
| LogP | 2.9795 |
| Topological Polar Surface Area | 63.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.98337 |
| Heavy Atoms | 21 |
| Complexity | 664.5236 |
Chemical Identifiers
| CAS Number | 335214-59-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CN=CC=C2)Br |
Product Overview
N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea (CAS 335214-59-0), with molecular formula C14H12BrN3O2S and molecular weight 364.98 g/mol. IUPAC: 3-bromo-4-methoxy-N-(pyridin-3-ylcarbamothioyl)benzamide.
Chemical Property Profile of N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea
Property Insights of N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea
The XLogP value of 2.9795 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea. The TPSA of 63.25 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea. Following Lipinski's Rule of Five, N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea has 2 hydrogen bond donor(s) and 4 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 N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea?
The CAS number of N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea is 335214-59-0.
What is the molecular formula of N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea?
The molecular formula of N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea is C14H12BrN3O2S.
What is the molecular weight of N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea?
The molecular weight of N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea is 364.98 g/mol.
Where can I buy N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea?
You can request a quote for N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(3-bromo-4-methoxybenzoyl)-N'-(3-pyridinyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.