N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide
TL;DR: N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide (CAS 868375-67-1) is a chemical compound with molecular formula C13H14F2N2OS and molecular weight 284.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide
Also Known As: F1814-1794, N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide, (Z)-N-(3-ethyl-4,6-difluorobenzo[d]thiazol-2(3H)-ylidene)butyramide, N-[(2Z)-3-ethyl-4,6-difluoro-2,3-dihydro-1,3-benzothiazol-2-ylidene]butanamide, N-(3-Ethyl-4,6-difluorobenzo[d]thiazol-2(3H)-ylidene)butyramide
| Molecular Formula | C13H14F2N2OS |
|---|---|
| Molecular Weight | 284.08 g/mol |
| LogP | 3.2283 |
| Topological Polar Surface Area | 34.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.0795 |
| Heavy Atoms | 19 |
| Complexity | 687.7434 |
Chemical Identifiers
| CAS Number | 868375-67-1 |
|---|---|
| SMILES | CCCC(=O)N=C1N(C2=C(C=C(C=C2S1)F)F)CC |
Product Overview
N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide (CAS 868375-67-1), with molecular formula C13H14F2N2OS and molecular weight 284.08 g/mol. IUPAC: N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide.
Chemical Property Profile of N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide
Property Insights of N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide
The XLogP value of 3.2283 indicates that N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.36 Ų, N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide has 0 hydrogen bond donor(s) and 2 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 N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide?
The CAS number of N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide is 868375-67-1.
What is the molecular formula of N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide?
The molecular formula of N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide is C13H14F2N2OS.
What is the molecular weight of N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide?
The molecular weight of N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide is 284.08 g/mol.
Where can I buy N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide?
You can request a quote for N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-ethyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.