BAS 04995966
TL;DR: BAS 04995966 (CAS 683807-17-2) is a chemical compound with molecular formula C23H23N5O3 and molecular weight 417.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-cyclopentyl-N-(furan-2-ylmethyl)-6-imino-13-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: BAS 04995966, 1-Cyclopentyl-2-imino-6-methyl-10-oxo-1,10-dihydro-2H-1,9,10a-triaza-anthracene-3-carboxylic acid (furan-2-ylmethyl)-amide, 1-cyclopentyl-N-(2-furanylmethyl)-2-imino-8-methyl-5-oxo-3-dipyrido[1,2-d:3'',4''-f]pyrimidinecarboxamide, 1-cyclopentyl-N-(2-furfuryl)-2-imino-5-keto-8-methyl-dipyrido[1,2-d:3'',4''-f]pyrimidine-3-carboxamide, 1-cyclopentyl-N-(furan-2-ylmethyl)-2-imino-8-methyl-5-oxodipyrido[1,2-d:3'',4''-f]pyrimidine-3-carboxamide
| Molecular Formula | C23H23N5O3 |
|---|---|
| Molecular Weight | 417.18 g/mol |
| LogP | 3.07519 |
| Topological Polar Surface Area | 105.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 417.18008 |
| Heavy Atoms | 31 |
| Complexity | 1409.438 |
Chemical Identifiers
| CAS Number | 683807-17-2 |
|---|---|
| SMILES | CC1=CN2C(=NC3=C(C2=O)C=C(C(=N)N3C4CCCC4)C(=O)NCC5=CC=CO5)C=C1 |
Product Overview
BAS 04995966 (CAS 683807-17-2), with molecular formula C23H23N5O3 and molecular weight 417.18 g/mol. IUPAC: 7-cyclopentyl-N-(furan-2-ylmethyl)-6-imino-13-methyl-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of BAS 04995966
Property Insights of BAS 04995966
The XLogP value of 3.07519 indicates that BAS 04995966 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04995966. Following Lipinski's Rule of Five, BAS 04995966 has 2 hydrogen bond donor(s) and 5 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 04995966?
The CAS number of BAS 04995966 is 683807-17-2.
What is the molecular formula of BAS 04995966?
The molecular formula of BAS 04995966 is C23H23N5O3.
What is the molecular weight of BAS 04995966?
The molecular weight of BAS 04995966 is 417.18 g/mol.
Where can I buy BAS 04995966?
You can request a quote for BAS 04995966 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04995966?
Yes, KEHONG BIO provides custom synthesis services for BAS 04995966 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.