RefChem:1089138
TL;DR: RefChem:1089138 (CAS 51490-41-6) is a chemical compound with molecular formula C23H31ClN2O and molecular weight 386.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-3-[(E)-[phenyl(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)methylidene]amino]oxypropan-1-amine;hydrochloride
Also Known As: C23H30N2O.ClH.1/2H2O, C23-H30-N2-O.Cl-H.1/2H2-O, Methanone, phenyl(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)-, O-(3-(dimethylamino)propyl)oxime, hydrochloride, hydrate (2:2:1), O-(3-Dimethylaminopropyl)-2-benzoyl-6,7,8,9-tetrahydro-5H-benzocycloheptenoxime HCl 1/2H2O, RefChem:1089138
| Molecular Formula | C23H31ClN2O |
|---|---|
| Molecular Weight | 386.21 g/mol |
| LogP | 5.098 |
| Topological Polar Surface Area | 24.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 386.2125 |
| Heavy Atoms | 27 |
| Complexity | 728.41315 |
Chemical Identifiers
| CAS Number | 51490-41-6 |
|---|---|
| SMILES | CN(C)CCCO/N=C(\C1=CC=CC=C1)/C2=CC3=C(CCCCC3)C=C2.Cl |
Product Overview
RefChem:1089138 (CAS 51490-41-6), with molecular formula C23H31ClN2O and molecular weight 386.21 g/mol. IUPAC: N,N-dimethyl-3-[(E)-[phenyl(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)methylidene]amino]oxypropan-1-amine;hydrochloride.
Chemical Property Profile of RefChem:1089138
Property Insights of RefChem:1089138
The XLogP value of 5.098 indicates that RefChem:1089138 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.83 Ų, RefChem:1089138 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1089138 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1089138?
The CAS number of RefChem:1089138 is 51490-41-6.
What is the molecular formula of RefChem:1089138?
The molecular formula of RefChem:1089138 is C23H31ClN2O.
What is the molecular weight of RefChem:1089138?
The molecular weight of RefChem:1089138 is 386.21 g/mol.
Where can I buy RefChem:1089138?
You can request a quote for RefChem:1089138 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1089138?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1089138 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.