![ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate structure](/static/products/142/1429221-21-5.webp)
ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate
TL;DR: ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate (CAS 1429221-21-5) is a chemical compound with molecular formula C11H12N4O2S and molecular weight 264.06808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl N-[(E)-N'-(1,3-benzothiazol-2-yl)carbamimidoyl]carbamate
Also Known As: ethyl [amino(1,3-benzothiazol-2-ylamino)methylene]carbamate, ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate, ethyl N-[(E)-N''-(1,3-benzothiazol-2-yl)carbamimidoyl]carbamate, ethyl N-[(1E)-amino[(1,3-benzothiazol-2-yl)amino]methylidene]carbamate, N-[(E)-amino(1,3-benzothiazol-2-ylimino)methyl]carbamic acid ethyl ester
Technical Specifications
| Molecular Formula | C11H12N4O2S |
| Molecular Weight | 264.06808 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.06808 Da |
| Heavy Atoms | 18 |
| Complexity | 337.0 |
| SMILES | CCOC(=O)N/C(=N/C1=NC2=CC=CC=C2S1)/N |
| InChIKey | ZELFANKHJXEMGR-UHFFFAOYSA-N |
Chemical Property Profile of ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate
Property Insights of ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate. Following Lipinski's Rule of Five, ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate?
The CAS number of ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate is 1429221-21-5.
What is the molecular formula of ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate?
The molecular formula of ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate is C11H12N4O2S.
What is the molecular weight of ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate?
The molecular weight of ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate is 264.06808 g/mol.
Where can I buy ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate?
You can request a quote for ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate?
Yes, CoreyChem provides custom synthesis services for ethyl [(E)-amino(1,3-benzothiazol-2-ylamino)methylidene]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.