RefChem:1098254
TL;DR: RefChem:1098254 (CAS 67367-88-8) is a chemical compound with molecular formula C28H35NO5 and molecular weight 465.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N-(1,2,3,5,6,7-hexahydro-s-indacen-4-ylmethoxymethyl)propan-2-amine;(Z)-but-2-enedioic acid
Also Known As: 1,2,3,5,6,7-Hexahydro-alpha-((benzylisopropylamino)methyl)-s-indacene-4-methanol maleate, s-Indacene-4-methanol, 1,2,3,5,6,7-hexahydro-alpha-(((1-methylethyl)(phenylmethyl)amino)methyl)-, (Z)-2-butenedioate (1:1), N-benzyl-N-(1,2,3,5,6,7-hexahydro-s-indacen-4-ylmethoxymethyl)propan-2-amine; (Z)-but-2-enedioic acid, RefChem:1098254
| Molecular Formula | C28H35NO5 |
|---|---|
| Molecular Weight | 465.25 g/mol |
| LogP | 4.7605 |
| Topological Polar Surface Area | 87.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 465.25153 |
| Heavy Atoms | 34 |
| Complexity | 964.9517 |
Chemical Identifiers
| CAS Number | 67367-88-8 |
|---|---|
| SMILES | CC(C)N(CC1=CC=CC=C1)COCC2=C3CCCC3=CC4=C2CCC4.C(=C\C(=O)O)\C(=O)O |
Product Overview
RefChem:1098254 (CAS 67367-88-8), with molecular formula C28H35NO5 and molecular weight 465.25 g/mol. IUPAC: N-benzyl-N-(1,2,3,5,6,7-hexahydro-s-indacen-4-ylmethoxymethyl)propan-2-amine;(Z)-but-2-enedioic acid.
Chemical Property Profile of RefChem:1098254
Property Insights of RefChem:1098254
The XLogP value of 4.7605 indicates that RefChem:1098254 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.07 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1098254. Following Lipinski's Rule of Five, RefChem:1098254 has 2 hydrogen bond donor(s) and 4 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 RefChem:1098254?
The CAS number of RefChem:1098254 is 67367-88-8.
What is the molecular formula of RefChem:1098254?
The molecular formula of RefChem:1098254 is C28H35NO5.
What is the molecular weight of RefChem:1098254?
The molecular weight of RefChem:1098254 is 465.25 g/mol.
Where can I buy RefChem:1098254?
You can request a quote for RefChem:1098254 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1098254?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1098254 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.