ZERO/005352
TL;DR: ZERO/005352 (CAS 1217065-38-7) is a chemical compound with molecular formula C21H30N2O and molecular weight 326.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4'-tert-butyl-6-methoxyspiro[2,3,4,9-tetrahydropyrido[3,4-b]indole-1,1'-cyclohexane]
Also Known As: ZERO/005352, 4'-tert-butyl-6-methoxy-2,3,4,9-tetrahydrospiro[beta-carboline-1,1'-cyclohexane] hydrochloride, 4'-tert-butyl-6-methoxy-2,3,4,9-tetrahydrospiro[beta-carboline-1,1'-cyclohexane], 4'-tert-butyl-6-methoxyspiro[2,3,4,9-tetrahydropyrido[3,4-b]indole-1,1'-cyclohexane], 14-(tert-butyl)-6-methoxyspiro[1,2,3,4-tetrahydrobeta-carboline-1,4'-cyclohexa ne]
| Molecular Formula | C21H30N2O |
|---|---|
| Molecular Weight | 326.24 g/mol |
| LogP | 4.7538 |
| Topological Polar Surface Area | 37.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 326.2358 |
| Heavy Atoms | 24 |
| Complexity | 745.0199 |
Chemical Identifiers
| CAS Number | 1217065-38-7 |
|---|---|
| SMILES | CC(C)(C)C1CCC2(CC1)C3=C(CCN2)C4=C(N3)C=CC(=C4)OC |
Product Overview
ZERO/005352 (CAS 1217065-38-7), with molecular formula C21H30N2O and molecular weight 326.24 g/mol. IUPAC: 4'-tert-butyl-6-methoxyspiro[2,3,4,9-tetrahydropyrido[3,4-b]indole-1,1'-cyclohexane].
Chemical Property Profile of ZERO/005352
Property Insights of ZERO/005352
The XLogP value of 4.7538 indicates that ZERO/005352 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.05 Ų, ZERO/005352 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ZERO/005352 has 2 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 ZERO/005352?
The CAS number of ZERO/005352 is 1217065-38-7.
What is the molecular formula of ZERO/005352?
The molecular formula of ZERO/005352 is C21H30N2O.
What is the molecular weight of ZERO/005352?
The molecular weight of ZERO/005352 is 326.24 g/mol.
Where can I buy ZERO/005352?
You can request a quote for ZERO/005352 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ZERO/005352?
Yes, KEHONG BIO provides custom synthesis services for ZERO/005352 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.