F1105-0444
TL;DR: F1105-0444 (CAS 683247-51-0) is a chemical compound with molecular formula C23H26N4O7S3 and molecular weight 566.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[4-[(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate
Also Known As: F1105-0444, (Z)-ethyl 4-((4-((3-methyl-6-(methylsulfonyl)benzo[d]thiazol-2(3H)-ylidene)carbamoyl)phenyl)sulfonyl)piperazine-1-carboxylate, ethyl 4-(4-{[(2Z)-6-methanesulfonyl-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]carbamoyl}benzenesulfonyl)piperazine-1-carboxylate, ethyl 4-[4-[(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate
| Molecular Formula | C23H26N4O7S3 |
|---|---|
| Molecular Weight | 566.10 g/mol |
| LogP | 1.8472 |
| Topological Polar Surface Area | 135.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 566.0964 |
| Heavy Atoms | 37 |
| Complexity | 1631.441 |
Chemical Identifiers
| CAS Number | 683247-51-0 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)S(=O)(=O)C)C |
Product Overview
F1105-0444 (CAS 683247-51-0), with molecular formula C23H26N4O7S3 and molecular weight 566.10 g/mol. IUPAC: ethyl 4-[4-[(3-methyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate.
Chemical Property Profile of F1105-0444
Property Insights of F1105-0444
The XLogP value of 1.8472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1105-0444. The TPSA of 135.42 Ų falls within the moderate polarity range, balancing permeability and solubility for F1105-0444. Following Lipinski's Rule of Five, F1105-0444 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1105-0444?
The CAS number of F1105-0444 is 683247-51-0.
What is the molecular formula of F1105-0444?
The molecular formula of F1105-0444 is C23H26N4O7S3.
What is the molecular weight of F1105-0444?
The molecular weight of F1105-0444 is 566.10 g/mol.
Where can I buy F1105-0444?
You can request a quote for F1105-0444 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1105-0444?
Yes, KEHONG BIO provides custom synthesis services for F1105-0444 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.