EINECS 252-797-1
TL;DR: EINECS 252-797-1 (CAS 35926-76-2) is a chemical compound with molecular formula C23H21N and molecular weight 311.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylspiro[1H-isoindole-3,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene]
Also Known As: EINECS 252-797-1, ICCB1_000147, 2',3',10,11-Tetrahydro-2'-methylspiro(5H-dibenzo(a,d)cycloheptene-5,1'-(1H)isoindole), 2',3',10,11-Tetrahydro-2'-methylspiro[5H-dibenzo[a,d]cycloheptene-5,1'-[1H]isoindole], Spiro[5H-dibenzo[a,d]cycloheptene-5,1'-[1H]isoindole], 2',3',10,11-tetrahydro-2'-methyl-
| Molecular Formula | C23H21N |
|---|---|
| Molecular Weight | 311.17 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 311.1674 |
| Heavy Atoms | 24 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 35926-76-2 |
|---|---|
| SMILES | CN1CC2=CC=CC=C2C13C4=CC=CC=C4CCC5=CC=CC=C35 |
| InChIKey | LHTVZDOHGJLKNS-UHFFFAOYSA-N |
Product Overview
EINECS 252-797-1 (CAS 35926-76-2), with molecular formula C23H21N and molecular weight 311.17 g/mol. IUPAC: 2-methylspiro[1H-isoindole-3,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene].
Chemical Property Profile of EINECS 252-797-1
Property Insights of EINECS 252-797-1
The XLogP value of 4.8 indicates that EINECS 252-797-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, EINECS 252-797-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, EINECS 252-797-1 has 0 hydrogen bond donor(s) and 1 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 252-797-1?
The CAS number of EINECS 252-797-1 is 35926-76-2.
What is the molecular formula of EINECS 252-797-1?
The molecular formula of EINECS 252-797-1 is C23H21N.
What is the molecular weight of EINECS 252-797-1?
The molecular weight of EINECS 252-797-1 is 311.17 g/mol.
Where can I buy EINECS 252-797-1?
You can request a quote for EINECS 252-797-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 252-797-1?
Yes, KEHONG BIO provides custom synthesis services for EINECS 252-797-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.