RefChem:1071893
TL;DR: RefChem:1071893 (CAS 100447-52-7) is a chemical compound with molecular formula C19H24N2O and molecular weight 296.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-3-(5-ethyl-6-oxa-4-azatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaen-2-ylidene)-N,N-dimethylpropan-1-amine
Also Known As: 4H-Benzo(5,6)cyclohept(1,2-d)oxazole, 9,10-dihydro-4-(3-(dimethylamino)propylidene)-2-ethyl-, 9,10-Dihydro-4-(3-(dimethylamino)propylidene)-2-ethyl-4H-benzo(5,6)cyclohept(1,2-d)oxazole, 4H-BENZO(5,6)CYCLOHEPT(1,2-d)OXAZOLE, 9,10-DIHYDRO-4-(3-(DIMETHYLAMINO)PROPYLIDE, (3Z)-3-(2-ethyl-4,5-dihydrobenzo[1,2]cyclohepta[3,4-b][1,3]oxazol-10-ylidene)-N,N-dimethylpropan-1-amine, [3-(2-ethyl-9,10-dihydro-benzo[5,6]cyclohepta[1,2-d]oxazol-4-ylidene)-propyl]-dimethyl-amine
| Molecular Formula | C19H24N2O |
|---|---|
| Molecular Weight | 296.19 g/mol |
| LogP | 3.719 |
| Topological Polar Surface Area | 29.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.18887 |
| Heavy Atoms | 22 |
| Complexity | 682.49365 |
Chemical Identifiers
| CAS Number | 100447-52-7 |
|---|---|
| SMILES | CCC1=NC\2=C(O1)CCC3=CC=CC=C3/C2=C/CCN(C)C |
Product Overview
RefChem:1071893 (CAS 100447-52-7), with molecular formula C19H24N2O and molecular weight 296.19 g/mol. IUPAC: (3Z)-3-(5-ethyl-6-oxa-4-azatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaen-2-ylidene)-N,N-dimethylpropan-1-amine.
Chemical Property Profile of RefChem:1071893
Property Insights of RefChem:1071893
The XLogP value of 3.719 indicates that RefChem:1071893 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.27 Ų, RefChem:1071893 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1071893 has 0 hydrogen bond donor(s) and 3 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:1071893?
The CAS number of RefChem:1071893 is 100447-52-7.
What is the molecular formula of RefChem:1071893?
The molecular formula of RefChem:1071893 is C19H24N2O.
What is the molecular weight of RefChem:1071893?
The molecular weight of RefChem:1071893 is 296.19 g/mol.
Where can I buy RefChem:1071893?
You can request a quote for RefChem:1071893 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1071893?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1071893 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.