2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole
TL;DR: 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole (CAS 14071-89-7) is a chemical compound with molecular formula C11H13N3O2S and molecular weight 251.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]carbamate
Also Known As: 2,3-DIHYDRO-2-(ETHOXYCARBONYLHYDRAZINYLYLIDENE)-3-METHYLBENZOTHIAZOLE, Ethyl N-[(3-methylbenzothiazol-2-ylidene)amino]carbamate, 653-132-1, RefChem:442302
| Molecular Formula | C11H13N3O2S |
|---|---|
| Molecular Weight | 251.07 g/mol |
| LogP | 1.8016 |
| Topological Polar Surface Area | 55.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.07285 |
| Heavy Atoms | 17 |
| Complexity | 600.0275 |
Chemical Identifiers
| CAS Number | 14071-89-7 |
|---|---|
| SMILES | CCOC(=O)N/N=C/1\N(C2=CC=CC=C2S1)C |
Product Overview
2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole (CAS 14071-89-7), with molecular formula C11H13N3O2S and molecular weight 251.07 g/mol. IUPAC: ethyl N-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]carbamate.
Chemical Property Profile of 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole
Property Insights of 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole
The XLogP value of 1.8016 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole. With a topological polar surface area (TPSA) of 55.62 Ų, 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole has 1 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 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole?
The CAS number of 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole is 14071-89-7.
What is the molecular formula of 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole?
The molecular formula of 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole is C11H13N3O2S.
What is the molecular weight of 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole?
The molecular weight of 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole is 251.07 g/mol.
Where can I buy 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole?
You can request a quote for 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dihydro-2-(ethoxycarbonylhydrazinylylidene)-3-methylbenzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.