F1838-1813
TL;DR: F1838-1813 (CAS 868974-38-3) is a chemical compound with molecular formula C14H14N4O4S2 and molecular weight 366.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide
Also Known As: F1838-1813, N-[5-({[(2H-1,3-benzodioxol-5-yl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]propanamide, N-[5-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide, N-(5-((2-(benzo[d][1,3]dioxol-5-ylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)propionamide
| Molecular Formula | C14H14N4O4S2 |
|---|---|
| Molecular Weight | 366.05 g/mol |
| LogP | 2.3461 |
| Topological Polar Surface Area | 102.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 366.04565 |
| Heavy Atoms | 24 |
| Complexity | 764.9828 |
Chemical Identifiers
| CAS Number | 868974-38-3 |
|---|---|
| SMILES | CCC(=O)NC1=NN=C(S1)SCC(=O)NC2=CC3=C(C=C2)OCO3 |
Product Overview
F1838-1813 (CAS 868974-38-3), with molecular formula C14H14N4O4S2 and molecular weight 366.05 g/mol. IUPAC: N-[5-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide.
Chemical Property Profile of F1838-1813
Property Insights of F1838-1813
The XLogP value of 2.3461 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1838-1813. The TPSA of 102.44 Ų falls within the moderate polarity range, balancing permeability and solubility for F1838-1813. Following Lipinski's Rule of Five, F1838-1813 has 2 hydrogen bond donor(s) and 8 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 F1838-1813?
The CAS number of F1838-1813 is 868974-38-3.
What is the molecular formula of F1838-1813?
The molecular formula of F1838-1813 is C14H14N4O4S2.
What is the molecular weight of F1838-1813?
The molecular weight of F1838-1813 is 366.05 g/mol.
Where can I buy F1838-1813?
You can request a quote for F1838-1813 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1838-1813?
Yes, KEHONG BIO provides custom synthesis services for F1838-1813 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.