ChemDiv2_006191
TL;DR: ChemDiv2_006191 (CAS 896846-59-6) is a chemical compound with molecular formula C14H13N5O2 and molecular weight 283.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
Also Known As: ChemDiv2_006191, IDI1_004906, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine, N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
| Molecular Formula | C14H13N5O2 |
|---|---|
| Molecular Weight | 283.11 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 73.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.10693 |
| Heavy Atoms | 21 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 896846-59-6 |
|---|---|
| SMILES | CC1=NC2=NC=NN2C(=C1)NC3=CC4=C(C=C3)OCCO4 |
| InChIKey | BCIUTCOIWNUOCL-UHFFFAOYSA-N |
Product Overview
ChemDiv2_006191 (CAS 896846-59-6), with molecular formula C14H13N5O2 and molecular weight 283.11 g/mol. IUPAC: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine.
Chemical Property Profile of ChemDiv2_006191
Property Insights of ChemDiv2_006191
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv2_006191. The TPSA of 73.6 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_006191. Following Lipinski's Rule of Five, ChemDiv2_006191 has 1 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 ChemDiv2_006191?
The CAS number of ChemDiv2_006191 is 896846-59-6.
What is the molecular formula of ChemDiv2_006191?
The molecular formula of ChemDiv2_006191 is C14H13N5O2.
What is the molecular weight of ChemDiv2_006191?
The molecular weight of ChemDiv2_006191 is 283.11 g/mol.
Where can I buy ChemDiv2_006191?
You can request a quote for ChemDiv2_006191 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_006191?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_006191 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.