A2786/0117770
TL;DR: A2786/0117770 (CAS 446027-59-4) is a chemical compound with molecular formula C16H15N3O2S2 and molecular weight 345.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-(methoxymethyl)-11-methyl-4-thiophen-2-yl-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),9,11-tetraen-6-one
Also Known As: A2786/0117770, 4-Methoxymethyl-2-methyl-6-thiophen-2-yl-6,7-dihydro-5H-9-thia-1,5,7-triaza-fluoren-8-one, 9-(methoxymethyl)-7-methyl-2-(2-thienyl)-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one, 9-(methoxymethyl)-7-methyl-2-(thiophen-2-yl)-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one, 9-(methoxymethyl)-7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-pyrido[1,2]thieno[3,4-d]pyrimidin-4-one
| Molecular Formula | C16H15N3O2S2 |
|---|---|
| Molecular Weight | 345.06 g/mol |
| LogP | 3.66672 |
| Topological Polar Surface Area | 63.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.06058 |
| Heavy Atoms | 23 |
| Complexity | 886.5027 |
Chemical Identifiers
| CAS Number | 446027-59-4 |
|---|---|
| SMILES | CC1=CC(=C2C3=C(C(=O)NC(N3)C4=CC=CS4)SC2=N1)COC |
Product Overview
A2786/0117770 (CAS 446027-59-4), with molecular formula C16H15N3O2S2 and molecular weight 345.06 g/mol. IUPAC: 13-(methoxymethyl)-11-methyl-4-thiophen-2-yl-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),9,11-tetraen-6-one.
Chemical Property Profile of A2786/0117770
Property Insights of A2786/0117770
The XLogP value of 3.66672 indicates that A2786/0117770 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.25 Ų falls within the moderate polarity range, balancing permeability and solubility for A2786/0117770. Following Lipinski's Rule of Five, A2786/0117770 has 2 hydrogen bond donor(s) and 6 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 A2786/0117770?
The CAS number of A2786/0117770 is 446027-59-4.
What is the molecular formula of A2786/0117770?
The molecular formula of A2786/0117770 is C16H15N3O2S2.
What is the molecular weight of A2786/0117770?
The molecular weight of A2786/0117770 is 345.06 g/mol.
Where can I buy A2786/0117770?
You can request a quote for A2786/0117770 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2786/0117770?
Yes, KEHONG BIO provides custom synthesis services for A2786/0117770 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.