BAS 01817291
TL;DR: BAS 01817291 (CAS 424811-10-9) is a chemical compound with molecular formula C21H21BrN4O3 and molecular weight 456.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-bromo-2-hydroxy-1-(pyrrolidin-1-ylmethyl)indol-3-yl]imino-4-methoxybenzamide
Also Known As: BAS 01817291, BIM-0043503.P001, N-[(Z)-[5-bromo-2-oxo-1-(pyrrolidin-1-ylmethyl)indol-3-ylidene]amino]-4-methoxybenzamide, (Z)-N'-(5-bromo-2-oxo-1-(pyrrolidin-1-ylmethyl)indolin-3-ylidene)-4-methoxybenzohydrazide, N-[(E)-[5-bromo-2-oxo-1-(pyrrolidin-1-ylmethyl)indol-3-ylidene]amino]-4-methoxybenzamide
| Molecular Formula | C21H21BrN4O3 |
|---|---|
| Molecular Weight | 456.08 g/mol |
| LogP | 5.0954 |
| Topological Polar Surface Area | 79.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 456.0797 |
| Heavy Atoms | 29 |
| Complexity | 1069.7148 |
Chemical Identifiers
| CAS Number | 424811-10-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)N=NC2=C(N(C3=C2C=C(C=C3)Br)CN4CCCC4)O |
Product Overview
BAS 01817291 (CAS 424811-10-9), with molecular formula C21H21BrN4O3 and molecular weight 456.08 g/mol. IUPAC: N-[5-bromo-2-hydroxy-1-(pyrrolidin-1-ylmethyl)indol-3-yl]imino-4-methoxybenzamide.
Chemical Property Profile of BAS 01817291
Property Insights of BAS 01817291
The XLogP value of 5.0954 indicates that BAS 01817291 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.42 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01817291. Following Lipinski's Rule of Five, BAS 01817291 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01817291?
The CAS number of BAS 01817291 is 424811-10-9.
What is the molecular formula of BAS 01817291?
The molecular formula of BAS 01817291 is C21H21BrN4O3.
What is the molecular weight of BAS 01817291?
The molecular weight of BAS 01817291 is 456.08 g/mol.
Where can I buy BAS 01817291?
You can request a quote for BAS 01817291 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01817291?
Yes, KEHONG BIO provides custom synthesis services for BAS 01817291 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.