BAS 06900632
TL;DR: BAS 06900632 (CAS 445383-83-5) is a chemical compound with molecular formula C22H23N3O3S and molecular weight 409.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Also Known As: BAS 06900632, AM-807/14147711, 2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile, 2-((2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl)thio)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile, 2-({2-[6,7-dimethoxy-3,4-dihydro-2(1H)-isoquinolinyl]-2-oxoethyl}sulfanyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl cyanide
| Molecular Formula | C22H23N3O3S |
|---|---|
| Molecular Weight | 409.15 g/mol |
| LogP | 3.13618 |
| Topological Polar Surface Area | 75.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.14603 |
| Heavy Atoms | 29 |
| Complexity | 999.77264 |
Chemical Identifiers
| CAS Number | 445383-83-5 |
|---|---|
| SMILES | COC1=C(C=C2CN(CCC2=C1)C(=O)CSC3=C(C=C4CCCC4=N3)C#N)OC |
Product Overview
BAS 06900632 (CAS 445383-83-5), with molecular formula C22H23N3O3S and molecular weight 409.15 g/mol. IUPAC: 2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile.
Chemical Property Profile of BAS 06900632
Property Insights of BAS 06900632
The XLogP value of 3.13618 indicates that BAS 06900632 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.45 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06900632. Following Lipinski's Rule of Five, BAS 06900632 has 0 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 06900632?
The CAS number of BAS 06900632 is 445383-83-5.
What is the molecular formula of BAS 06900632?
The molecular formula of BAS 06900632 is C22H23N3O3S.
What is the molecular weight of BAS 06900632?
The molecular weight of BAS 06900632 is 409.15 g/mol.
Where can I buy BAS 06900632?
You can request a quote for BAS 06900632 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06900632?
Yes, KEHONG BIO provides custom synthesis services for BAS 06900632 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.