A3913/0166425
TL;DR: A3913/0166425 (CAS 371925-21-2) is a chemical compound with molecular formula C27H32N6OS2 and molecular weight 520.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-8-morpholin-4-yl-N-(4-phenylbutan-2-yl)-5,11-dithia-9,14,15,16-tetrazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-amine
Also Known As: A3913/0166425, 2,2-dimethyl-5-morpholino-N-(4-phenylbutan-2-yl)-2,4-dihydro-1H-thiopyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-8-amine, 2,2-dimethyl-5-(morpholin-4-yl)-N-(4-phenylbutan-2-yl)-1,4-dihydro-2H-thiopyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-8-amine, N-(2,2-DIMETHYL-5-MORPHOLINO-1,4-DIHYDRO-2H-THIOPYRANO[4'',3'':4',5']PYRIDO[3',2':4,5]THIENO[3,2-D][1,2,3]TRIAZIN-8-YL)-N-(1-METHYL-3-PHENYLPROPYL)AMINE
| Molecular Formula | C27H32N6OS2 |
|---|---|
| Molecular Weight | 520.21 g/mol |
| LogP | 5.4722 |
| Topological Polar Surface Area | 76.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 520.2079 |
| Heavy Atoms | 36 |
| Complexity | 1383.8093 |
Chemical Identifiers
| CAS Number | 371925-21-2 |
|---|---|
| SMILES | CC(CCC1=CC=CC=C1)NC2=NN=NC3=C2SC4=C3C5=C(CSC(C5)(C)C)C(=N4)N6CCOCC6 |
Product Overview
A3913/0166425 (CAS 371925-21-2), with molecular formula C27H32N6OS2 and molecular weight 520.21 g/mol. IUPAC: 4,4-dimethyl-8-morpholin-4-yl-N-(4-phenylbutan-2-yl)-5,11-dithia-9,14,15,16-tetrazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-amine.
Chemical Property Profile of A3913/0166425
Property Insights of A3913/0166425
The XLogP value of 5.4722 indicates that A3913/0166425 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.06 Ų falls within the moderate polarity range, balancing permeability and solubility for A3913/0166425. Following Lipinski's Rule of Five, A3913/0166425 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3913/0166425?
The CAS number of A3913/0166425 is 371925-21-2.
What is the molecular formula of A3913/0166425?
The molecular formula of A3913/0166425 is C27H32N6OS2.
What is the molecular weight of A3913/0166425?
The molecular weight of A3913/0166425 is 520.21 g/mol.
Where can I buy A3913/0166425?
You can request a quote for A3913/0166425 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3913/0166425?
Yes, KEHONG BIO provides custom synthesis services for A3913/0166425 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.