F1816-0382
TL;DR: F1816-0382 (CAS 868377-62-2) is a chemical compound with molecular formula C16H11N3O3S2 and molecular weight 357.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-5-nitrothiophene-2-carboxamide
Also Known As: F1816-0382, N-[(2Z)-4-methyl-3-(prop-2-yn-1-yl)-2,3-dihydro-1,3-benzothiazol-2-ylidene]-5-nitrothiophene-2-carboxamide, N-(4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-5-nitrothiophene-2-carboxamide, (Z)-N-(4-methyl-3-(prop-2-yn-1-yl)benzo[d]thiazol-2(3H)-ylidene)-5-nitrothiophene-2-carboxamide
| Molecular Formula | C16H11N3O3S2 |
|---|---|
| Molecular Weight | 357.02 g/mol |
| LogP | 3.35522 |
| Topological Polar Surface Area | 77.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.02417 |
| Heavy Atoms | 24 |
| Complexity | 1066.3529 |
Chemical Identifiers
| CAS Number | 868377-62-2 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)SC(=NC(=O)C3=CC=C(S3)[N+](=O)[O-])N2CC#C |
Product Overview
F1816-0382 (CAS 868377-62-2), with molecular formula C16H11N3O3S2 and molecular weight 357.02 g/mol. IUPAC: N-(4-methyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-5-nitrothiophene-2-carboxamide.
Chemical Property Profile of F1816-0382
Property Insights of F1816-0382
The XLogP value of 3.35522 indicates that F1816-0382 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.5 Ų falls within the moderate polarity range, balancing permeability and solubility for F1816-0382. Following Lipinski's Rule of Five, F1816-0382 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 F1816-0382?
The CAS number of F1816-0382 is 868377-62-2.
What is the molecular formula of F1816-0382?
The molecular formula of F1816-0382 is C16H11N3O3S2.
What is the molecular weight of F1816-0382?
The molecular weight of F1816-0382 is 357.02 g/mol.
Where can I buy F1816-0382?
You can request a quote for F1816-0382 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1816-0382?
Yes, KEHONG BIO provides custom synthesis services for F1816-0382 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.