A3300/0140255
TL;DR: A3300/0140255 (CAS 1005073-85-7) is a chemical compound with molecular formula C20H18N4O3 and molecular weight 362.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-imino-9-(4-methoxyphenyl)-10,11-dioxatricyclo[5.3.2.01,6]dodecane-7,8,8-tricarbonitrile
Also Known As: A3300/0140255, 10-imino-2-(4-methoxyphenyl)hexahydro-8a,4-(epoxymethano)chromene-3,3,4(2H)-tricarbonitrile, 10-imino-2-(4-methoxyphenyl)tetrahydro-8a,4-(epoxymethano)chromene-3,3,4(2H,4aH)-tricarbonitrile
| Molecular Formula | C20H18N4O3 |
|---|---|
| Molecular Weight | 362.14 g/mol |
| LogP | 3.20401 |
| Topological Polar Surface Area | 122.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 362.13788 |
| Heavy Atoms | 27 |
| Complexity | 908.5208 |
Chemical Identifiers
| CAS Number | 1005073-85-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2C(C3(C4CCCCC4(O2)OC3=N)C#N)(C#N)C#N |
Product Overview
A3300/0140255 (CAS 1005073-85-7), with molecular formula C20H18N4O3 and molecular weight 362.14 g/mol. IUPAC: 12-imino-9-(4-methoxyphenyl)-10,11-dioxatricyclo[5.3.2.01,6]dodecane-7,8,8-tricarbonitrile.
Chemical Property Profile of A3300/0140255
Property Insights of A3300/0140255
The XLogP value of 3.20401 indicates that A3300/0140255 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.91 Ų falls within the moderate polarity range, balancing permeability and solubility for A3300/0140255. Following Lipinski's Rule of Five, A3300/0140255 has 1 hydrogen bond donor(s) and 7 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 A3300/0140255?
The CAS number of A3300/0140255 is 1005073-85-7.
What is the molecular formula of A3300/0140255?
The molecular formula of A3300/0140255 is C20H18N4O3.
What is the molecular weight of A3300/0140255?
The molecular weight of A3300/0140255 is 362.14 g/mol.
Where can I buy A3300/0140255?
You can request a quote for A3300/0140255 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3300/0140255?
Yes, KEHONG BIO provides custom synthesis services for A3300/0140255 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.