BIM-0025599.P001
TL;DR: BIM-0025599.P001 (CAS 5600-23-7) is a chemical compound with molecular formula C23H23BrN2O2 and molecular weight 438.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-[3-(4-bromophenyl)-8-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl]pent-3-en-2-one
Also Known As: BIM-0025599.P001, (E)-4-[3-(4-bromophenyl)-8-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl]pent-3-en-2-one, (3E)-4-[3-(4-Bromophenyl)-8-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl]pent-3-en-2-one, 4-(3-(4-BR-PH)-8-MEO-3,3A,4,5-TETRAHYDRO-2H-BENZO(G)INDAZOL-2-YL)-3-PENTEN-2-ONE
| Molecular Formula | C23H23BrN2O2 |
|---|---|
| Molecular Weight | 438.09 g/mol |
| LogP | 5.2739 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.0943 |
| Heavy Atoms | 28 |
| Complexity | 978.59686 |
Chemical Identifiers
| CAS Number | 5600-23-7 |
|---|---|
| SMILES | C/C(=C\C(=O)C)/N1C(C2CCC3=C(C2=N1)C=C(C=C3)OC)C4=CC=C(C=C4)Br |
Product Overview
BIM-0025599.P001 (CAS 5600-23-7), with molecular formula C23H23BrN2O2 and molecular weight 438.09 g/mol. IUPAC: (E)-4-[3-(4-bromophenyl)-8-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl]pent-3-en-2-one.
Chemical Property Profile of BIM-0025599.P001
Property Insights of BIM-0025599.P001
The XLogP value of 5.2739 indicates that BIM-0025599.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.9 Ų, BIM-0025599.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0025599.P001 has 0 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 BIM-0025599.P001?
The CAS number of BIM-0025599.P001 is 5600-23-7.
What is the molecular formula of BIM-0025599.P001?
The molecular formula of BIM-0025599.P001 is C23H23BrN2O2.
What is the molecular weight of BIM-0025599.P001?
The molecular weight of BIM-0025599.P001 is 438.09 g/mol.
Where can I buy BIM-0025599.P001?
You can request a quote for BIM-0025599.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0025599.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0025599.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.