N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide
TL;DR: N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide (CAS 77414-55-2) is a chemical compound with molecular formula C12H12N2O2S and molecular weight 248.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide
Also Known As: N-(4-Methoxy-2-benzothiazolyl)cyclopropanecarboxamide, N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide, N-(4-methoxybenzothiazol-2-yl)cyclopropanecarboxamide
| Molecular Formula | C12H12N2O2S |
|---|---|
| Molecular Weight | 248.06 g/mol |
| LogP | 2.6534 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.06195 |
| Heavy Atoms | 17 |
| Complexity | 574.88934 |
Chemical Identifiers
| CAS Number | 77414-55-2 |
|---|---|
| SMILES | COC1=C2C(=CC=C1)SC(=N2)NC(=O)C3CC3 |
Product Overview
N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide (CAS 77414-55-2), with molecular formula C12H12N2O2S and molecular weight 248.06 g/mol. IUPAC: N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide.
Chemical Property Profile of N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide
Property Insights of N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide
The XLogP value of 2.6534 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide. With a topological polar surface area (TPSA) of 51.22 Ų, N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide 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 N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide?
The CAS number of N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide is 77414-55-2.
What is the molecular formula of N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide?
The molecular formula of N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide is C12H12N2O2S.
What is the molecular weight of N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide?
The molecular weight of N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide is 248.06 g/mol.
Where can I buy N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide?
You can request a quote for N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.