![3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide structure](/static/products/333/333773-83-4.png)
3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide
TL;DR: 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide (CAS 333773-83-4) is a chemical compound with molecular formula C21H16N2O2 and molecular weight 328.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-imino-N-(4-methylphenyl)benzo[f]chromene-2-carboxamide
Also Known As: BAS 01020691, 3-imino-N-(p-tolyl)-3H-benzo[f]chromene-2-carboxamide, 3-Imino-3H-benzo[f]chromene-2-carboxylic acid p-tolylamide, 3-imino-N-(4-methylphenyl)benzo[f]chromene-2-carboxamide, 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide
| Molecular Formula | C21H16N2O2 |
|---|---|
| Molecular Weight | 328.12 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.1212 |
| Heavy Atoms | 25 |
| Complexity | 562.0 |
Chemical Identifiers
| CAS Number | 333773-83-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC4=CC=CC=C43)OC2=N |
| InChIKey | LXVQZPAOAAXTQS-UHFFFAOYSA-N |
Product Overview
3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide (CAS 333773-83-4), with molecular formula C21H16N2O2 and molecular weight 328.12 g/mol. IUPAC: 3-imino-N-(4-methylphenyl)benzo[f]chromene-2-carboxamide.
Chemical Property Profile of 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide
Property Insights of 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide
The XLogP value of 4.7 indicates that 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide. Following Lipinski's Rule of Five, 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide has 2 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 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide?
The CAS number of 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide is 333773-83-4.
What is the molecular formula of 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide?
The molecular formula of 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide is C21H16N2O2.
What is the molecular weight of 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide?
The molecular weight of 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide is 328.12 g/mol.
Where can I buy 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide?
You can request a quote for 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-imino-N-(4-methylphenyl)-3H-benzo[f]chromene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.