F1301-0090
TL;DR: F1301-0090 (CAS 864937-86-0) is a chemical compound with molecular formula C20H18N2O3S2 and molecular weight 398.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2,3-dihydro-1,4-dioxine-5-carboxamide
Also Known As: F1301-0090, N-(3-(benzo[d]thiazol-2-yl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-5,6-dihydro-1,4-dioxine-2-carboxamide, N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5,6-dihydro-1,4-dioxine-2-carboxamide, N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2,3-dihydro-1,4-dioxine-5-carboxamide
| Molecular Formula | C20H18N2O3S2 |
|---|---|
| Molecular Weight | 398.08 g/mol |
| LogP | 4.7303 |
| Topological Polar Surface Area | 60.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 398.0759 |
| Heavy Atoms | 27 |
| Complexity | 1017.86005 |
Chemical Identifiers
| CAS Number | 864937-86-0 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=COCCO3)C4=NC5=CC=CC=C5S4 |
Product Overview
F1301-0090 (CAS 864937-86-0), with molecular formula C20H18N2O3S2 and molecular weight 398.08 g/mol. IUPAC: N-[3-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2,3-dihydro-1,4-dioxine-5-carboxamide.
Chemical Property Profile of F1301-0090
Property Insights of F1301-0090
The XLogP value of 4.7303 indicates that F1301-0090 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.45 Ų falls within the moderate polarity range, balancing permeability and solubility for F1301-0090. Following Lipinski's Rule of Five, F1301-0090 has 1 hydrogen bond donor(s) and 6 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 F1301-0090?
The CAS number of F1301-0090 is 864937-86-0.
What is the molecular formula of F1301-0090?
The molecular formula of F1301-0090 is C20H18N2O3S2.
What is the molecular weight of F1301-0090?
The molecular weight of F1301-0090 is 398.08 g/mol.
Where can I buy F1301-0090?
You can request a quote for F1301-0090 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1301-0090?
Yes, KEHONG BIO provides custom synthesis services for F1301-0090 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.