RefChem:305595
TL;DR: RefChem:305595 (CAS 4687-46-1) is a chemical compound with molecular formula C22H27N and molecular weight 305.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidene)propan-1-amine
Also Known As: 5H-Dibenzo(a,d)cycloheptene-delta(sup 5),gamma-propylamine, 10,11-dihydro-N,N-diethyl-, N,N-Diethyl-10,11-dihydro-5H-dibenzo(a,d)cycloheptene-delta(sup 5),gamma-propylamine, 5-<3-Diaethylamino-propyliden>-dibenzo
| Molecular Formula | C22H27N |
|---|---|
| Molecular Weight | 305.21 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 305.21436 |
| Heavy Atoms | 23 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 4687-46-1 |
|---|---|
| SMILES | CCN(CC)CCC=C1C2=CC=CC=C2CCC3=CC=CC=C31 |
| InChIKey | ZQRSWEVZDIGGOC-UHFFFAOYSA-N |
Product Overview
RefChem:305595 (CAS 4687-46-1), with molecular formula C22H27N and molecular weight 305.21 g/mol. IUPAC: N,N-diethyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidene)propan-1-amine.
Chemical Property Profile of RefChem:305595
Property Insights of RefChem:305595
The XLogP value of 5.8 indicates that RefChem:305595 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, RefChem:305595 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:305595 has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:305595?
The CAS number of RefChem:305595 is 4687-46-1.
What is the molecular formula of RefChem:305595?
The molecular formula of RefChem:305595 is C22H27N.
What is the molecular weight of RefChem:305595?
The molecular weight of RefChem:305595 is 305.21 g/mol.
Where can I buy RefChem:305595?
You can request a quote for RefChem:305595 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:305595?
Yes, KEHONG BIO provides custom synthesis services for RefChem:305595 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.