EINECS 251-973-5
TL;DR: EINECS 251-973-5 (CAS 3905-76-8) is a chemical compound with molecular formula C18H23N3 and molecular weight 281.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
20-methyl-8,10,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),14,16,18-tetraene
Also Known As: EINECS 251-973-5, 2H,6H-Pyrido(1'',2'':3',4')imidazo(1',5':1,2)pyrido(3,4-b)indole, 1,3,4,8,9,14,14b,14c-octahydro-14-methyl-, 14-Methyl-1,3,4,8,9,14,14b,14c-octahydro-2H,6H-pyrido[1'',2'':3',4']imidazo[1',5':1,2]pyrido[3,4-b]indole, RefChem:267540
| Molecular Formula | C18H23N3 |
|---|---|
| Molecular Weight | 281.19 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 11.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 281.1892 |
| Heavy Atoms | 21 |
| Complexity | 411.0 |
Chemical Identifiers
| CAS Number | 3905-76-8 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C3=C1C4C5CCCCN5CN4CC3 |
| InChIKey | JFEWGKDLXZGZNM-UHFFFAOYSA-N |
Product Overview
EINECS 251-973-5 (CAS 3905-76-8), with molecular formula C18H23N3 and molecular weight 281.19 g/mol. IUPAC: 20-methyl-8,10,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),14,16,18-tetraene.
Chemical Property Profile of EINECS 251-973-5
Property Insights of EINECS 251-973-5
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 251-973-5. With a topological polar surface area (TPSA) of 11.4 Ų, EINECS 251-973-5 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, EINECS 251-973-5 has 0 hydrogen bond donor(s) and 2 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 EINECS 251-973-5?
The CAS number of EINECS 251-973-5 is 3905-76-8.
What is the molecular formula of EINECS 251-973-5?
The molecular formula of EINECS 251-973-5 is C18H23N3.
What is the molecular weight of EINECS 251-973-5?
The molecular weight of EINECS 251-973-5 is 281.19 g/mol.
Where can I buy EINECS 251-973-5?
You can request a quote for EINECS 251-973-5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 251-973-5?
Yes, KEHONG BIO provides custom synthesis services for EINECS 251-973-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.