F1816-0318
TL;DR: F1816-0318 (CAS 868377-34-8) is a chemical compound with molecular formula C21H18ClN3O4S2 and molecular weight 475.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-morpholin-4-ylsulfonylbenzamide
Also Known As: F1816-0318, N-[(2Z)-4-chloro-3-(prop-2-yn-1-yl)-2,3-dihydro-1,3-benzothiazol-2-ylidene]-4-(morpholine-4-sulfonyl)benzamide, N-(4-chloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-morpholin-4-ylsulfonylbenzamide, (Z)-N-(4-chloro-3-(prop-2-yn-1-yl)benzo[d]thiazol-2(3H)-ylidene)-4-(morpholinosulfonyl)benzamide, N-(4-chloro-3-prop-2-ynyl-benzothiazol-2-ylidene)-4-morpholin-4-ylsulfonyl-benzamide
| Molecular Formula | C21H18ClN3O4S2 |
|---|---|
| Molecular Weight | 475.04 g/mol |
| LogP | 2.7514 |
| Topological Polar Surface Area | 80.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 475.04272 |
| Heavy Atoms | 31 |
| Complexity | 1346.008 |
Chemical Identifiers
| CAS Number | 868377-34-8 |
|---|---|
| SMILES | C#CCN1C2=C(C=CC=C2Cl)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4 |
Product Overview
F1816-0318 (CAS 868377-34-8), with molecular formula C21H18ClN3O4S2 and molecular weight 475.04 g/mol. IUPAC: N-(4-chloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-morpholin-4-ylsulfonylbenzamide.
Chemical Property Profile of F1816-0318
Property Insights of F1816-0318
The XLogP value of 2.7514 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1816-0318. The TPSA of 80.97 Ų falls within the moderate polarity range, balancing permeability and solubility for F1816-0318. Following Lipinski's Rule of Five, F1816-0318 has 0 hydrogen bond donor(s) and 5 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 F1816-0318?
The CAS number of F1816-0318 is 868377-34-8.
What is the molecular formula of F1816-0318?
The molecular formula of F1816-0318 is C21H18ClN3O4S2.
What is the molecular weight of F1816-0318?
The molecular weight of F1816-0318 is 475.04 g/mol.
Where can I buy F1816-0318?
You can request a quote for F1816-0318 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1816-0318?
Yes, KEHONG BIO provides custom synthesis services for F1816-0318 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.