BAS 12457938
TL;DR: BAS 12457938 (CAS 577983-89-2) is a chemical compound with molecular formula C20H25N5O2S and molecular weight 399.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methoxypropyl)-7-morpholin-4-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-amine
Also Known As: BAS 12457938, N-(3-methoxypropyl)-4-(morpholin-4-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine, N-(3-methoxypropyl)-4-morpholino-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
| Molecular Formula | C20H25N5O2S |
|---|---|
| Molecular Weight | 399.17 g/mol |
| LogP | 3.0132 |
| Topological Polar Surface Area | 72.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 399.17288 |
| Heavy Atoms | 28 |
| Complexity | 999.32916 |
Chemical Identifiers
| CAS Number | 577983-89-2 |
|---|---|
| SMILES | COCCCNC1=NC=NC2=C1SC3=C2C4=C(CCC4)C(=N3)N5CCOCC5 |
Product Overview
BAS 12457938 (CAS 577983-89-2), with molecular formula C20H25N5O2S and molecular weight 399.17 g/mol. IUPAC: N-(3-methoxypropyl)-7-morpholin-4-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-amine.
Chemical Property Profile of BAS 12457938
Property Insights of BAS 12457938
The XLogP value of 3.0132 indicates that BAS 12457938 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.4 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12457938. Following Lipinski's Rule of Five, BAS 12457938 has 1 hydrogen bond donor(s) and 8 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 12457938?
The CAS number of BAS 12457938 is 577983-89-2.
What is the molecular formula of BAS 12457938?
The molecular formula of BAS 12457938 is C20H25N5O2S.
What is the molecular weight of BAS 12457938?
The molecular weight of BAS 12457938 is 399.17 g/mol.
Where can I buy BAS 12457938?
You can request a quote for BAS 12457938 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12457938?
Yes, KEHONG BIO provides custom synthesis services for BAS 12457938 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.