1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea
TL;DR: 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea (CAS 134150-40-6) is a chemical compound with molecular formula C12H12N4OS2 and molecular weight 292.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-prop-2-enyl-3-[4-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)phenyl]thiourea
Also Known As: 1-allyl-3-(4-(5-mercapto-1,3,4-oxadiazol-2-yl)phenyl)thiourea, 1-allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea, 1-Allyl-3-[4-(5-mercapto-[1,3,4]oxadiazol-2-yl)-phenyl]-thiourea, 1-(2-Propenyl)-3-[4-[(5-thioxo-4,5-dihydro-1,3,4-oxadiazol)-2-yl]phenyl]thiourea, 1-prop-2-enyl-3-[4-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)phenyl]thiourea
| Molecular Formula | C12H12N4OS2 |
|---|---|
| Molecular Weight | 292.05 g/mol |
| LogP | 2.87159 |
| Topological Polar Surface Area | 65.88 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.04526 |
| Heavy Atoms | 19 |
| Complexity | 629.67896 |
Chemical Identifiers
| CAS Number | 134150-40-6 |
|---|---|
| SMILES | C=CCNC(=S)NC1=CC=C(C=C1)C2=NNC(=S)O2 |
Product Overview
1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea (CAS 134150-40-6), with molecular formula C12H12N4OS2 and molecular weight 292.05 g/mol. IUPAC: 1-prop-2-enyl-3-[4-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)phenyl]thiourea.
Chemical Property Profile of 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea
Property Insights of 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea
The XLogP value of 2.87159 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea. The TPSA of 65.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea. Following Lipinski's Rule of Five, 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea has 3 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 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea?
The CAS number of 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea is 134150-40-6.
What is the molecular formula of 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea?
The molecular formula of 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea is C12H12N4OS2.
What is the molecular weight of 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea?
The molecular weight of 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea is 292.05 g/mol.
Where can I buy 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea?
You can request a quote for 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Allyl-3-[4-(5-sulfanyl-1,3,4-oxadiazol-2-yl)phenyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.