(E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide
TL;DR: (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide (CAS 6284-10-2) is a chemical compound with molecular formula C13H15N3O3S and molecular weight 293.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)butanamide
Also Known As: F1381-0801, N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)butanamide, (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide
| Molecular Formula | C13H15N3O3S |
|---|---|
| Molecular Weight | 293.08 g/mol |
| LogP | 2.8583 |
| Topological Polar Surface Area | 77.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.0834 |
| Heavy Atoms | 20 |
| Complexity | 730.02686 |
Chemical Identifiers
| CAS Number | 6284-10-2 |
|---|---|
| SMILES | CCCC(=O)N=C1N(C2=C(S1)C=C(C=C2)[N+](=O)[O-])CC |
Product Overview
(E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide (CAS 6284-10-2), with molecular formula C13H15N3O3S and molecular weight 293.08 g/mol. IUPAC: N-(3-ethyl-6-nitro-1,3-benzothiazol-2-ylidene)butanamide.
Chemical Property Profile of (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide
Property Insights of (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide
The XLogP value of 2.8583 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide. The TPSA of 77.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide. Following Lipinski's Rule of Five, (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide has 0 hydrogen bond donor(s) and 4 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 (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide?
The CAS number of (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide is 6284-10-2.
What is the molecular formula of (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide?
The molecular formula of (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide is C13H15N3O3S.
What is the molecular weight of (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide?
The molecular weight of (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide is 293.08 g/mol.
Where can I buy (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide?
You can request a quote for (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(3-ethyl-6-nitrobenzo[d]thiazol-2(3H)-ylidene)butyramide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.