![N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide structure](/static/products/7123/712322-58-2.webp)
N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide (CAS 712322-58-2) is a chemical compound with molecular formula C19H21N3O7S and molecular weight 435.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide
Also Known As: N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide, N-(1,3-benzodioxol-5-ylmethyl)-4-{methyl[(4-nitrophenyl)sulfonyl]amino}butanamide
| Molecular Formula | C19H21N3O7S |
|---|---|
| Molecular Weight | 435.11 g/mol |
| LogP | 2.0406 |
| Topological Polar Surface Area | 128.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 435.11002 |
| Heavy Atoms | 30 |
| Complexity | 1038.5936 |
Chemical Identifiers
| CAS Number | 712322-58-2 |
|---|---|
| SMILES | CN(CCCC(=O)NCC1=CC2=C(C=C1)OCO2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide (CAS 712322-58-2), with molecular formula C19H21N3O7S and molecular weight 435.11 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide
The XLogP value of 2.0406 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide. The TPSA of 128.08 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide has 1 hydrogen bond donor(s) and 7 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-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide is 712322-58-2.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide is C19H21N3O7S.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide is 435.11 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide 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-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-4-[methyl-(4-nitrophenyl)sulfonylamino]butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.