N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide (CAS 840455-81-4) is a chemical compound with molecular formula C20H23NO4S and molecular weight 373.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide
Also Known As: N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)thiophene-2-carboxamide, N-(benzo[d][1,3]dioxol-5-ylmethyl)-N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)thiophene-2-carboxamide
| Molecular Formula | C20H23NO4S |
|---|---|
| Molecular Weight | 373.13 g/mol |
| LogP | 4.0768 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 373.13477 |
| Heavy Atoms | 26 |
| Complexity | 787.1138 |
Chemical Identifiers
| CAS Number | 840455-81-4 |
|---|---|
| SMILES | CC1(CC(CCO1)N(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CS4)C |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide (CAS 840455-81-4), with molecular formula C20H23NO4S and molecular weight 373.13 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide
The XLogP value of 4.0768 indicates that N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.0 Ų, N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide has 0 hydrogen bond donor(s) and 5 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)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide is 840455-81-4.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide is C20H23NO4S.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide is 373.13 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide 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)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-N-(2,2-dimethyloxan-4-yl)thiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.