N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea
TL;DR: N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea (CAS 335209-04-6) is a chemical compound with molecular formula C14H15N3OS2 and molecular weight 305.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(dimethylamino)phenyl]carbamothioyl]thiophene-2-carboxamide
Also Known As: N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea, N-[[4-(dimethylamino)phenyl]carbamothioyl]thiophene-2-carboxamide, N-[(4-dimethylaminophenyl)carbamothioyl]thiophene-2-carboxamide, N-{[4-(dimethylamino)phenyl]carbamothioyl}thiophene-2-carboxamide, N-({[4-(dimethylamino)phenyl]amino}thioxomethyl)-2-thienylcarboxamide
| Molecular Formula | C14H15N3OS2 |
|---|---|
| Molecular Weight | 305.07 g/mol |
| LogP | 2.9409 |
| Topological Polar Surface Area | 44.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.06564 |
| Heavy Atoms | 20 |
| Complexity | 591.3914 |
Chemical Identifiers
| CAS Number | 335209-04-6 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CS2 |
Product Overview
N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea (CAS 335209-04-6), with molecular formula C14H15N3OS2 and molecular weight 305.07 g/mol. IUPAC: N-[[4-(dimethylamino)phenyl]carbamothioyl]thiophene-2-carboxamide.
Chemical Property Profile of N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea
Property Insights of N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea
The XLogP value of 2.9409 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea. With a topological polar surface area (TPSA) of 44.37 Ų, N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)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-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea?
The CAS number of N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea is 335209-04-6.
What is the molecular formula of N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea?
The molecular formula of N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea is C14H15N3OS2.
What is the molecular weight of N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea?
The molecular weight of N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea is 305.07 g/mol.
Where can I buy N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea?
You can request a quote for N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(dimethylamino)phenyl]-N'-(thien-2-ylcarbonyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.