F1063-1472
TL;DR: F1063-1472 (CAS 613225-64-2) is a chemical compound with molecular formula C21H22N4O4S3 and molecular weight 490.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(Z)-[3-[6-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-6-oxohexyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate
Also Known As: F1063-1472, (Z)-methyl 4-((3-(6-((5-methyl-1,3,4-thiadiazol-2-yl)amino)-6-oxohexyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)benzoate, METHYL 4-{[(5Z)-3-{5-[(5-METHYL-1,3,4-THIADIAZOL-2-YL)CARBAMOYL]PENTYL}-4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-5-YLIDENE]METHYL}BENZOATE, methyl 4-[(Z)-[3-[6-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-6-oxohexyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate, methyl 4-[(3-{5-[N-(5-methyl(1,3,4-thiadiazol-2-yl))carbamoyl]pentyl}-4-oxo-2- thioxo-1,3-thiazolidin-5-ylidene)methyl]benzoate
| Molecular Formula | C21H22N4O4S3 |
|---|---|
| Molecular Weight | 490.08 g/mol |
| LogP | 4.03342 |
| Topological Polar Surface Area | 101.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 490.08032 |
| Heavy Atoms | 32 |
| Complexity | 1049.5691 |
Chemical Identifiers
| CAS Number | 613225-64-2 |
|---|---|
| SMILES | CC1=NN=C(S1)NC(=O)CCCCCN2C(=O)/C(=C/C3=CC=C(C=C3)C(=O)OC)/SC2=S |
Product Overview
F1063-1472 (CAS 613225-64-2), with molecular formula C21H22N4O4S3 and molecular weight 490.08 g/mol. IUPAC: methyl 4-[(Z)-[3-[6-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-6-oxohexyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoate.
Chemical Property Profile of F1063-1472
Property Insights of F1063-1472
The XLogP value of 4.03342 indicates that F1063-1472 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.49 Ų falls within the moderate polarity range, balancing permeability and solubility for F1063-1472. Following Lipinski's Rule of Five, F1063-1472 has 1 hydrogen bond donor(s) and 9 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 F1063-1472?
The CAS number of F1063-1472 is 613225-64-2.
What is the molecular formula of F1063-1472?
The molecular formula of F1063-1472 is C21H22N4O4S3.
What is the molecular weight of F1063-1472?
The molecular weight of F1063-1472 is 490.08 g/mol.
Where can I buy F1063-1472?
You can request a quote for F1063-1472 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1063-1472?
Yes, KEHONG BIO provides custom synthesis services for F1063-1472 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.