BAS 01107800
TL;DR: BAS 01107800 (CAS 336180-75-7) is a chemical compound with molecular formula C22H16N2O4 and molecular weight 372.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5-oxo-4-(4-prop-2-enoxyphenyl)-4H-pyrano[3,2-c]chromene-3-carbonitrile
Also Known As: BAS 01107800, 2-amino-5-oxo-4-[4-(prop-2-en-1-yloxy)phenyl]-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile, 2-amino-5-oxo-4-(4-prop-2-enoxyphenyl)-4H-pyrano[3,2-c]chromene-3-carbonitrile, 4-(4-(Allyloxy)phenyl)-2-amino-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile, 4-[4-(allyloxy)phenyl]-2-amino-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile
| Molecular Formula | C22H16N2O4 |
|---|---|
| Molecular Weight | 372.11 g/mol |
| LogP | 3.57598 |
| Topological Polar Surface Area | 98.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.111 |
| Heavy Atoms | 28 |
| Complexity | 1199.9192 |
Chemical Identifiers
| CAS Number | 336180-75-7 |
|---|---|
| SMILES | C=CCOC1=CC=C(C=C1)C2C(=C(OC3=C2C(=O)OC4=CC=CC=C43)N)C#N |
Product Overview
BAS 01107800 (CAS 336180-75-7), with molecular formula C22H16N2O4 and molecular weight 372.11 g/mol. IUPAC: 2-amino-5-oxo-4-(4-prop-2-enoxyphenyl)-4H-pyrano[3,2-c]chromene-3-carbonitrile.
Chemical Property Profile of BAS 01107800
Property Insights of BAS 01107800
The XLogP value of 3.57598 indicates that BAS 01107800 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.48 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01107800. Following Lipinski's Rule of Five, BAS 01107800 has 1 hydrogen bond donor(s) and 6 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 BAS 01107800?
The CAS number of BAS 01107800 is 336180-75-7.
What is the molecular formula of BAS 01107800?
The molecular formula of BAS 01107800 is C22H16N2O4.
What is the molecular weight of BAS 01107800?
The molecular weight of BAS 01107800 is 372.11 g/mol.
Where can I buy BAS 01107800?
You can request a quote for BAS 01107800 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01107800?
Yes, KEHONG BIO provides custom synthesis services for BAS 01107800 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.