N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide
TL;DR: N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide (CAS 431987-07-4) is a chemical compound with molecular formula C18H18N2O2S and molecular weight 326.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide
Also Known As: N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide, AB00119187-01, N-(6-methylbenzothiazol-2-yl)-4-phenoxybutanamide
| Molecular Formula | C18H18N2O2S |
|---|---|
| Molecular Weight | 326.11 g/mol |
| LogP | 4.40242 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 326.1089 |
| Heavy Atoms | 23 |
| Complexity | 799.1466 |
Chemical Identifiers
| CAS Number | 431987-07-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCOC3=CC=CC=C3 |
Product Overview
N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide (CAS 431987-07-4), with molecular formula C18H18N2O2S and molecular weight 326.11 g/mol. IUPAC: N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide.
Chemical Property Profile of N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide
Property Insights of N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide
The XLogP value of 4.40242 indicates that N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide 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-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide 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-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide?
The CAS number of N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide is 431987-07-4.
What is the molecular formula of N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide?
The molecular formula of N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide is C18H18N2O2S.
What is the molecular weight of N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide?
The molecular weight of N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide is 326.11 g/mol.
Where can I buy N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide?
You can request a quote for N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-methyl-1,3-benzothiazol-2-yl)-4-phenoxybutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.