BAS 00727886
TL;DR: BAS 00727886 (CAS 312605-54-2) is a chemical compound with molecular formula C25H26Br2N2O3 and molecular weight 560.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(3,6-dibromocarbazol-9-yl)-2-hydroxypropyl]-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane-2,4-dione
Also Known As: BAS 00727886, 3-[3-(3,6-dibromo-9H-carbazol-9-yl)-2-hydroxypropyl]-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane-2,4-dione, 3-[3-(3,6-dibromocarbazol-9-yl)-2-hydroxypropyl]-5,8,8-trimethyl-3-azabicyclo[3.2.1]octane-2,4-dione, 3-[3-(3,6-DIBROMOCARBAZOL-9-YL)-2-HYDROXYPROPYL]-1,8,8-TRIMETHYL-3-AZABICYCLO[3.2.1]OCTANE-2,4-DIONE
| Molecular Formula | C25H26Br2N2O3 |
|---|---|
| Molecular Weight | 560.03 g/mol |
| LogP | 5.4917 |
| Topological Polar Surface Area | 62.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 560.031 |
| Heavy Atoms | 32 |
| Complexity | 1221.9095 |
Chemical Identifiers
| CAS Number | 312605-54-2 |
|---|---|
| SMILES | CC1(C2CCC1(C(=O)N(C2=O)CC(CN3C4=C(C=C(C=C4)Br)C5=C3C=CC(=C5)Br)O)C)C |
Product Overview
BAS 00727886 (CAS 312605-54-2), with molecular formula C25H26Br2N2O3 and molecular weight 560.03 g/mol. IUPAC: 3-[3-(3,6-dibromocarbazol-9-yl)-2-hydroxypropyl]-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane-2,4-dione.
Chemical Property Profile of BAS 00727886
Property Insights of BAS 00727886
The XLogP value of 5.4917 indicates that BAS 00727886 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.54 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00727886. Following Lipinski's Rule of Five, BAS 00727886 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00727886?
The CAS number of BAS 00727886 is 312605-54-2.
What is the molecular formula of BAS 00727886?
The molecular formula of BAS 00727886 is C25H26Br2N2O3.
What is the molecular weight of BAS 00727886?
The molecular weight of BAS 00727886 is 560.03 g/mol.
Where can I buy BAS 00727886?
You can request a quote for BAS 00727886 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00727886?
Yes, KEHONG BIO provides custom synthesis services for BAS 00727886 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.