BAS 03789793
TL;DR: BAS 03789793 (CAS 256956-66-8) is a chemical compound with molecular formula C21H21N5OS and molecular weight 391.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dimethyl-2-phenyl-4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylamino)pyrazol-3-one
Also Known As: BAS 03789793, AF-399/41048326, 1,5-dimethyl-2-phenyl-4-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylamino)-1,2-dihydro-3H-pyrazol-3-one, BRD-K22905602-001-01-9, 1,5-dimethyl-2-phenyl-4-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)amino)-1H-pyrazol-3(2H)-one
| Molecular Formula | C21H21N5OS |
|---|---|
| Molecular Weight | 391.15 g/mol |
| LogP | 4.11152 |
| Topological Polar Surface Area | 64.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.14667 |
| Heavy Atoms | 28 |
| Complexity | 1235.3953 |
Chemical Identifiers
| CAS Number | 256956-66-8 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=C4C5=C(CCCC5)SC4=NC=N3 |
Product Overview
BAS 03789793 (CAS 256956-66-8), with molecular formula C21H21N5OS and molecular weight 391.15 g/mol. IUPAC: 1,5-dimethyl-2-phenyl-4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylamino)pyrazol-3-one.
Chemical Property Profile of BAS 03789793
Property Insights of BAS 03789793
The XLogP value of 4.11152 indicates that BAS 03789793 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.74 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03789793. Following Lipinski's Rule of Five, BAS 03789793 has 1 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 03789793?
The CAS number of BAS 03789793 is 256956-66-8.
What is the molecular formula of BAS 03789793?
The molecular formula of BAS 03789793 is C21H21N5OS.
What is the molecular weight of BAS 03789793?
The molecular weight of BAS 03789793 is 391.15 g/mol.
Where can I buy BAS 03789793?
You can request a quote for BAS 03789793 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03789793?
Yes, KEHONG BIO provides custom synthesis services for BAS 03789793 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.