BAS 04056297
TL;DR: BAS 04056297 (CAS 372495-52-8) is a chemical compound with molecular formula C20H25N7OS and molecular weight 411.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(13-piperazin-1-yl-11-thia-9,14,15,16-tetrazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-8-yl)morpholine
Also Known As: BAS 04056297, US9334288, 9, 4-(8-(piperazin-1-yl)-1,2,3,4-tetrahydro-[1,2,3]triazino[4',5':4,5]thieno[2,3-c]isoquinolin-5-yl)morpholine, 5-(morpholin-4-yl)-8-(piperazin-1-yl)-1,2,3,4-tetrahydro[1,2,3]triazino[4',5':4,5]thieno[2,3-c]isoquinoline, 4-(8-(piperazin-1-yl)-1,2,3,4-tetrahydro-(1,2,3)triazino(4',5':4,5)thieno(2,3-c)isoquinolin-5-yl)morpholine
| Molecular Formula | C20H25N7OS |
|---|---|
| Molecular Weight | 411.18 g/mol |
| LogP | 1.7595 |
| Topological Polar Surface Area | 79.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 411.18414 |
| Heavy Atoms | 29 |
| Complexity | 1056.0862 |
Chemical Identifiers
| CAS Number | 372495-52-8 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(N=C2N4CCOCC4)SC5=C3N=NN=C5N6CCNCC6 |
Product Overview
BAS 04056297 (CAS 372495-52-8), with molecular formula C20H25N7OS and molecular weight 411.18 g/mol. IUPAC: 4-(13-piperazin-1-yl-11-thia-9,14,15,16-tetrazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-8-yl)morpholine.
Chemical Property Profile of BAS 04056297
Property Insights of BAS 04056297
The XLogP value of 1.7595 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04056297. The TPSA of 79.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04056297. Following Lipinski's Rule of Five, BAS 04056297 has 1 hydrogen bond donor(s) and 9 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 04056297?
The CAS number of BAS 04056297 is 372495-52-8.
What is the molecular formula of BAS 04056297?
The molecular formula of BAS 04056297 is C20H25N7OS.
What is the molecular weight of BAS 04056297?
The molecular weight of BAS 04056297 is 411.18 g/mol.
Where can I buy BAS 04056297?
You can request a quote for BAS 04056297 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04056297?
Yes, KEHONG BIO provides custom synthesis services for BAS 04056297 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.