BAS 00801731
TL;DR: BAS 00801731 (CAS 328540-96-1) is a chemical compound with molecular formula C22H20Br2N4O2 and molecular weight 530.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[4-bromo-2-[[(2-hydrazinyl-2-oxoethyl)amino]-phenylmethyl]phenyl]benzamide
Also Known As: BAS 00801731, 4-bromo-N-[4-bromo-2-[[(2-hydrazinyl-2-oxoethyl)amino]-phenylmethyl]phenyl]benzamide, 4-bromo-N-(4-bromo-2-(((2-hydrazinyl-2-oxoethyl)amino)(phenyl)methyl)phenyl)benzamide, 4-Bromo-N-{4-bromo-2-[(hydrazinocarbonylmethyl-amino)-phenyl-methyl]-phenyl}-benzamide, 4-bromo-N-(4-bromo-2-{[(2-hydrazinyl-2-oxoethyl)amino](phenyl)methyl}phenyl)benzamide (non-preferred name)
| Molecular Formula | C22H20Br2N4O2 |
|---|---|
| Molecular Weight | 530.00 g/mol |
| LogP | 4.1328 |
| Topological Polar Surface Area | 96.25 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 529.9953 |
| Heavy Atoms | 30 |
| Complexity | 1027.0674 |
Chemical Identifiers
| CAS Number | 328540-96-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=C(C=CC(=C2)Br)NC(=O)C3=CC=C(C=C3)Br)NCC(=O)NN |
Product Overview
BAS 00801731 (CAS 328540-96-1), with molecular formula C22H20Br2N4O2 and molecular weight 530.00 g/mol. IUPAC: 4-bromo-N-[4-bromo-2-[[(2-hydrazinyl-2-oxoethyl)amino]-phenylmethyl]phenyl]benzamide.
Chemical Property Profile of BAS 00801731
Property Insights of BAS 00801731
The XLogP value of 4.1328 indicates that BAS 00801731 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.25 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00801731. Following Lipinski's Rule of Five, BAS 00801731 has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00801731?
The CAS number of BAS 00801731 is 328540-96-1.
What is the molecular formula of BAS 00801731?
The molecular formula of BAS 00801731 is C22H20Br2N4O2.
What is the molecular weight of BAS 00801731?
The molecular weight of BAS 00801731 is 530.00 g/mol.
Where can I buy BAS 00801731?
You can request a quote for BAS 00801731 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00801731?
Yes, KEHONG BIO provides custom synthesis services for BAS 00801731 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.