Bzo-Ala-OMe
TL;DR: Bzo-Ala-OMe (CAS 38767-91-8) is a chemical compound with molecular formula C21H29Cl2N3O4 and molecular weight 457.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]anilino]-5-oxocyclohepta-1,3,6-trien-1-yl]acetamide;dihydrochloride
Also Known As: Bzo-Ala-OMe, Acetamide, N-(4-((4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)amino)-5-oxo-1,3,6-cycloheptatrien-1-yl)-, dihydrochloride, ACETAMIDE,N-(4-((4-(2-HYDROXY-3-((ISOPROPYL)AMINO)PROPOXY)PHENYL)AMINO)-5-OXO-1,3,6-CYCLOHEPTATRIEN-1-YL)-,2HCL, n-[4-({4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}amino)-5-oxocyclohepta-1,3,6-trien-1-yl]acetamide dihydrochloride, N-(4-((4-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)amino)-5-oxocyclohepta-1,3,6-trien-1-yl)acetamide dihydrochloride
| Molecular Formula | C21H29Cl2N3O4 |
|---|---|
| Molecular Weight | 457.15 g/mol |
| LogP | 3.3301 |
| Topological Polar Surface Area | 99.7 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 457.1535 |
| Heavy Atoms | 30 |
| Complexity | 632.0 |
Chemical Identifiers
| CAS Number | 38767-91-8 |
|---|---|
| SMILES | CC(C)NCC(COC1=CC=C(C=C1)NC2=CC=C(C=CC2=O)NC(=O)C)O.Cl.Cl |
| InChIKey | MSGHIZOUECXWIV-UHFFFAOYSA-N |
Product Overview
Bzo-Ala-OMe (CAS 38767-91-8), with molecular formula C21H29Cl2N3O4 and molecular weight 457.15 g/mol. IUPAC: N-[4-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]anilino]-5-oxocyclohepta-1,3,6-trien-1-yl]acetamide;dihydrochloride.
Chemical Property Profile of Bzo-Ala-OMe
Property Insights of Bzo-Ala-OMe
The XLogP value of 3.3301 indicates that Bzo-Ala-OMe is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Bzo-Ala-OMe. Following Lipinski's Rule of Five, Bzo-Ala-OMe has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bzo-Ala-OMe?
The CAS number of Bzo-Ala-OMe is 38767-91-8.
What is the molecular formula of Bzo-Ala-OMe?
The molecular formula of Bzo-Ala-OMe is C21H29Cl2N3O4.
What is the molecular weight of Bzo-Ala-OMe?
The molecular weight of Bzo-Ala-OMe is 457.15 g/mol.
Where can I buy Bzo-Ala-OMe?
You can request a quote for Bzo-Ala-OMe directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bzo-Ala-OMe?
Yes, KEHONG BIO provides custom synthesis services for Bzo-Ala-OMe and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.