BRN 3638550
TL;DR: BRN 3638550 (CAS 127786-22-5) is a chemical compound with molecular formula C30H23N7O2 and molecular weight 513.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(hydrazinecarbonyl)phenyl]imino-N'-[4-oxo-2-[(E)-2-phenylethenyl]quinazolin-3-yl]benzenecarboximidamide
Also Known As: Benzoic acid, 4-((((4-oxo-2-(2-phenylethenyl)-3(4H)-quinazolinyl)imino)phenylmethyl)azo)-, hydrazide, 6-Aminomethyl-6,11-dihydro-5H-dibenz[b,e]azepine (E)-2-butenedioate, N-[4-(hydrazinecarbonyl)phenyl]imino-N'-[4-oxo-2-[(E)-2-phenylethenyl]quinazolin-3-yl]benzenecarboximidamide, BRN 3638550
| Molecular Formula | C30H23N7O2 |
|---|---|
| Molecular Weight | 513.19 g/mol |
| LogP | 5.1642 |
| Topological Polar Surface Area | 127.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 513.19135 |
| Heavy Atoms | 39 |
| Complexity | 1759.2181 |
Chemical Identifiers
| CAS Number | 127786-22-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C2=NC3=CC=CC=C3C(=O)N2/N=C(/C4=CC=CC=C4)\N=NC5=CC=C(C=C5)C(=O)NN |
Product Overview
BRN 3638550 (CAS 127786-22-5), with molecular formula C30H23N7O2 and molecular weight 513.19 g/mol. IUPAC: N-[4-(hydrazinecarbonyl)phenyl]imino-N'-[4-oxo-2-[(E)-2-phenylethenyl]quinazolin-3-yl]benzenecarboximidamide.
Chemical Property Profile of BRN 3638550
Property Insights of BRN 3638550
The XLogP value of 5.1642 indicates that BRN 3638550 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.09 Ų falls within the moderate polarity range, balancing permeability and solubility for BRN 3638550. Following Lipinski's Rule of Five, BRN 3638550 has 2 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 BRN 3638550?
The CAS number of BRN 3638550 is 127786-22-5.
What is the molecular formula of BRN 3638550?
The molecular formula of BRN 3638550 is C30H23N7O2.
What is the molecular weight of BRN 3638550?
The molecular weight of BRN 3638550 is 513.19 g/mol.
Where can I buy BRN 3638550?
You can request a quote for BRN 3638550 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRN 3638550?
Yes, KEHONG BIO provides custom synthesis services for BRN 3638550 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.