BAS 04085756
TL;DR: BAS 04085756 (CAS 433704-59-7) is a chemical compound with molecular formula C20H12ClN3O3 and molecular weight 377.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-5,7,9-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),3(8),11,13,15-pentaene-4,6,17-trione
Also Known As: BAS 04085756, 5-(4-chlorophenyl)-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione, 2-(4-CHLOROPHENYL)-5,7,9-TRIAZATETRACYCLO[8.7.0.0(3),?.0(1)(1),(1)?]HEPTADECA-1(10),3(8),11(16),12,14-PENTAENE-4,6,17-TRIONE, 5-(4-chlorophenyl)-1,3,5,11-tetrahydroindeno[3,2-b]pyrimidino[5,4-e]pyridine-2 ,4,6-trione, 5-(4-chlorophenyl)-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H,5H,11H)-trione
| Molecular Formula | C20H12ClN3O3 |
|---|---|
| Molecular Weight | 377.06 g/mol |
| LogP | 2.8816 |
| Topological Polar Surface Area | 94.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 377.05673 |
| Heavy Atoms | 27 |
| Complexity | 1268.6198 |
Chemical Identifiers
| CAS Number | 433704-59-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(C2=O)C(C4=C(N3)NC(=O)NC4=O)C5=CC=C(C=C5)Cl |
Product Overview
BAS 04085756 (CAS 433704-59-7), with molecular formula C20H12ClN3O3 and molecular weight 377.06 g/mol. IUPAC: 2-(4-chlorophenyl)-5,7,9-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),3(8),11,13,15-pentaene-4,6,17-trione.
Chemical Property Profile of BAS 04085756
Property Insights of BAS 04085756
The XLogP value of 2.8816 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04085756. The TPSA of 94.82 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04085756. Following Lipinski's Rule of Five, BAS 04085756 has 3 hydrogen bond donor(s) and 4 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 04085756?
The CAS number of BAS 04085756 is 433704-59-7.
What is the molecular formula of BAS 04085756?
The molecular formula of BAS 04085756 is C20H12ClN3O3.
What is the molecular weight of BAS 04085756?
The molecular weight of BAS 04085756 is 377.06 g/mol.
Where can I buy BAS 04085756?
You can request a quote for BAS 04085756 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04085756?
Yes, KEHONG BIO provides custom synthesis services for BAS 04085756 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.