N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide
TL;DR: N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide (CAS 852137-29-2) is a chemical compound with molecular formula C19H18N2O3 and molecular weight 322.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide
Also Known As: IFLab1_002880, IDI1_009339, N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide, N-[(1,2-dimethylindol-5-yl)methyl]-piperonylamide, N-[(1,2-dimethyl-1H-indol-5-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
| Molecular Formula | C19H18N2O3 |
|---|---|
| Molecular Weight | 322.13 g/mol |
| LogP | 3.14542 |
| Topological Polar Surface Area | 52.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.13174 |
| Heavy Atoms | 24 |
| Complexity | 943.18005 |
Chemical Identifiers
| CAS Number | 852137-29-2 |
|---|---|
| SMILES | CC1=CC2=C(N1C)C=CC(=C2)CNC(=O)C3=CC4=C(C=C3)OCO4 |
Product Overview
N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide (CAS 852137-29-2), with molecular formula C19H18N2O3 and molecular weight 322.13 g/mol. IUPAC: N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide
Property Insights of N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide
The XLogP value of 3.14542 indicates that N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.49 Ų, N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide has 1 hydrogen bond donor(s) and 3 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-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide?
The CAS number of N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide is 852137-29-2.
What is the molecular formula of N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide?
The molecular formula of N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide is C19H18N2O3.
What is the molecular weight of N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide?
The molecular weight of N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide is 322.13 g/mol.
Where can I buy N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide?
You can request a quote for N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(1,2-dimethylindol-5-yl)methyl]-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.