2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide
TL;DR: 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide (CAS 315673-09-7) is a chemical compound with molecular formula C21H16N2O3 and molecular weight 344.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-ylmethylideneamino)-N-phenylbenzamide
Also Known As: 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide, AN-329/40357333, 2-(1,3-benzodioxol-5-ylmethylideneamino)-N-phenylbenzamide, 2-{[(E)-1,3-benzodioxol-5-ylmethylidene]amino}-N-phenylbenzamide, 2-[(E)-(2H-1,3-BENZODIOXOL-5-YLMETHYLIDENE)AMINO]-N-PHENYLBENZAMIDE
| Molecular Formula | C21H16N2O3 |
|---|---|
| Molecular Weight | 344.12 g/mol |
| LogP | 4.4182 |
| Topological Polar Surface Area | 59.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.1161 |
| Heavy Atoms | 26 |
| Complexity | 968.0 |
Chemical Identifiers
| CAS Number | 315673-09-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C=NC3=CC=CC=C3C(=O)NC4=CC=CC=C4 |
Product Overview
2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide (CAS 315673-09-7), with molecular formula C21H16N2O3 and molecular weight 344.12 g/mol. IUPAC: 2-(1,3-benzodioxol-5-ylmethylideneamino)-N-phenylbenzamide.
Chemical Property Profile of 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide
Property Insights of 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide
The XLogP value of 4.4182 indicates that 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.92 Ų, 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide 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 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide?
The CAS number of 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide is 315673-09-7.
What is the molecular formula of 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide?
The molecular formula of 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide is C21H16N2O3.
What is the molecular weight of 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide?
The molecular weight of 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide is 344.12 g/mol.
Where can I buy 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide?
You can request a quote for 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(1,3-benzodioxol-5-ylmethylene)amino]-N-phenylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.