BAS 00801576
TL;DR: BAS 00801576 (CAS 332018-10-7) is a chemical compound with molecular formula C25H15BrN2O5 and molecular weight 502.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-(4-bromo-2-nitrophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-1-carbaldehyde
Also Known As: BAS 00801576, 17-(4-bromo-2-nitrophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-1-carbaldehyde (non-preferred name), 13-(4-bromo-2-nitrophenyl)-12,14-dioxo-10,11,12,13,14,15-hexahydro-9H-9,10-[3,4]epipyrroloanthracene-9-carbaldehyde, 17-(4-Bromo-2-nitrophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-1-carbaldehyde, 17-(4-bromo-2-nitrophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0<2,7>.0<9,14>.0 <15,19>]nonadeca-2(7),3,5,9(14),10,12-hexaenecarbaldehyde
| Molecular Formula | C25H15BrN2O5 |
|---|---|
| Molecular Weight | 502.02 g/mol |
| LogP | 4.107 |
| Topological Polar Surface Area | 97.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 502.01642 |
| Heavy Atoms | 33 |
| Complexity | 1369.9111 |
Chemical Identifiers
| CAS Number | 332018-10-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3C4C(C2(C5=CC=CC=C35)C=O)C(=O)N(C4=O)C6=C(C=C(C=C6)Br)[N+](=O)[O-] |
Product Overview
BAS 00801576 (CAS 332018-10-7), with molecular formula C25H15BrN2O5 and molecular weight 502.02 g/mol. IUPAC: 17-(4-bromo-2-nitrophenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-1-carbaldehyde.
Chemical Property Profile of BAS 00801576
Property Insights of BAS 00801576
The XLogP value of 4.107 indicates that BAS 00801576 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.59 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00801576. Following Lipinski's Rule of Five, BAS 00801576 has 0 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 00801576?
The CAS number of BAS 00801576 is 332018-10-7.
What is the molecular formula of BAS 00801576?
The molecular formula of BAS 00801576 is C25H15BrN2O5.
What is the molecular weight of BAS 00801576?
The molecular weight of BAS 00801576 is 502.02 g/mol.
Where can I buy BAS 00801576?
You can request a quote for BAS 00801576 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00801576?
Yes, KEHONG BIO provides custom synthesis services for BAS 00801576 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.