N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide
TL;DR: N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide (CAS 876898-82-7) is a chemical compound with molecular formula C17H14N2O2S and molecular weight 310.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-3-prop-2-enoxybenzamide
Also Known As: 3-Allyloxy-N-benzothiazol-2-yl-benzamide, BAS 12520804, N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide, N-(1,3-benzothiazol-2-yl)-3-prop-2-enoxybenzamide
| Molecular Formula | C17H14N2O2S |
|---|---|
| Molecular Weight | 310.08 g/mol |
| LogP | 4.1134 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 310.0776 |
| Heavy Atoms | 22 |
| Complexity | 793.1468 |
Chemical Identifiers
| CAS Number | 876898-82-7 |
|---|---|
| SMILES | C=CCOC1=CC=CC(=C1)C(=O)NC2=NC3=CC=CC=C3S2 |
Product Overview
N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide (CAS 876898-82-7), with molecular formula C17H14N2O2S and molecular weight 310.08 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-3-prop-2-enoxybenzamide.
Chemical Property Profile of N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide
Property Insights of N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide
The XLogP value of 4.1134 indicates that N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide 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-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide?
The CAS number of N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide is 876898-82-7.
What is the molecular formula of N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide?
The molecular formula of N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide is C17H14N2O2S.
What is the molecular weight of N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide?
The molecular weight of N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide is 310.08 g/mol.
Where can I buy N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide?
You can request a quote for N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzothiazol-2-yl)-3-(prop-2-en-1-yloxy)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.