BAS 00276369
TL;DR: BAS 00276369 (CAS 330567-08-3) is a chemical compound with molecular formula C20H16Br2N4O4 and molecular weight 533.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[2-[(5,7-dibromo-2-hydroxy-1H-indol-3-yl)diazenyl]-2-oxoethyl]-3-(2-methoxyphenyl)prop-2-enamide
Also Known As: BAS 00276369, (2E)-N-({N-[(5,7-dibromo-2-oxo(1H-benzo[d]azolin-3-ylidene))azamethyl]carbamoy l}methyl)-3-(2-methoxyphenyl)prop-2-enamide, (2E)-N-{2-[(2Z)-2-(5,7-dibromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-2-oxoethyl}-3-(2-methoxyphenyl)prop-2-enamide (non-preferred name), (E)-N-(2-((Z)-2-(5,7-dibromo-2-oxoindolin-3-ylidene)hydrazinyl)-2-oxoethyl)-3-(2-methoxyphenyl)acrylamide, (E)-N-[2-[2-(5,7-dibromo-2-oxoindol-3-yl)hydrazinyl]-2-oxoethyl]-3-(2-methoxyphenyl)prop-2-enamide
| Molecular Formula | C20H16Br2N4O4 |
|---|---|
| Molecular Weight | 533.95 g/mol |
| LogP | 4.847 |
| Topological Polar Surface Area | 116.14 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 533.95386 |
| Heavy Atoms | 30 |
| Complexity | 1171.068 |
Chemical Identifiers
| CAS Number | 330567-08-3 |
|---|---|
| SMILES | COC1=CC=CC=C1/C=C/C(=O)NCC(=O)N=NC2=C(NC3=C2C=C(C=C3Br)Br)O |
Product Overview
BAS 00276369 (CAS 330567-08-3), with molecular formula C20H16Br2N4O4 and molecular weight 533.95 g/mol. IUPAC: (E)-N-[2-[(5,7-dibromo-2-hydroxy-1H-indol-3-yl)diazenyl]-2-oxoethyl]-3-(2-methoxyphenyl)prop-2-enamide.
Chemical Property Profile of BAS 00276369
Property Insights of BAS 00276369
The XLogP value of 4.847 indicates that BAS 00276369 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.14 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00276369. Following Lipinski's Rule of Five, BAS 00276369 has 3 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 00276369?
The CAS number of BAS 00276369 is 330567-08-3.
What is the molecular formula of BAS 00276369?
The molecular formula of BAS 00276369 is C20H16Br2N4O4.
What is the molecular weight of BAS 00276369?
The molecular weight of BAS 00276369 is 533.95 g/mol.
Where can I buy BAS 00276369?
You can request a quote for BAS 00276369 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00276369?
Yes, KEHONG BIO provides custom synthesis services for BAS 00276369 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.