BAS 00551898
TL;DR: BAS 00551898 (CAS 331750-98-2) is a chemical compound with molecular formula C26H22N2O4 and molecular weight 426.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(dimethoxymethyl)-17-pyridin-3-yl-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
Also Known As: BAS 00551898, A1807/0076375, (9S,10S,11S,15S)-9-(dimethoxymethyl)-13-(pyridin-3-yl)-11,15-dihydro-9H-9,10-[3,4]epipyrroloanthracene-12,14(10H,13H)-dione, 1-(dimethoxymethyl)-17-(3-pyridyl)-17-azapentacyclo[6.6.5.0<2,7>.0<9,14>.0<15, 19>]nonadeca-2(7),3,5,9,11,13-hexaene-16,18-dione, 1-(DIMETHOXYMETHYL)-17-(3-PYRIDYL)-17-AZAPENTACYCLO[6.6.5.0~2,7~.0~9,14~.0~15,19~]NONADECA-2,4,6,9(14),10,12-HEXAENE-16,18-DIONE
| Molecular Formula | C26H22N2O4 |
|---|---|
| Molecular Weight | 426.16 g/mol |
| LogP | 3.2513 |
| Topological Polar Surface Area | 68.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 426.15796 |
| Heavy Atoms | 32 |
| Complexity | 1189.839 |
Chemical Identifiers
| CAS Number | 331750-98-2 |
|---|---|
| SMILES | COC(C12C3C(C(C4=CC=CC=C41)C5=CC=CC=C25)C(=O)N(C3=O)C6=CN=CC=C6)OC |
Product Overview
BAS 00551898 (CAS 331750-98-2), with molecular formula C26H22N2O4 and molecular weight 426.16 g/mol. IUPAC: 1-(dimethoxymethyl)-17-pyridin-3-yl-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione.
Chemical Property Profile of BAS 00551898
Property Insights of BAS 00551898
The XLogP value of 3.2513 indicates that BAS 00551898 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.73 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00551898. Following Lipinski's Rule of Five, BAS 00551898 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00551898?
The CAS number of BAS 00551898 is 331750-98-2.
What is the molecular formula of BAS 00551898?
The molecular formula of BAS 00551898 is C26H22N2O4.
What is the molecular weight of BAS 00551898?
The molecular weight of BAS 00551898 is 426.16 g/mol.
Where can I buy BAS 00551898?
You can request a quote for BAS 00551898 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00551898?
Yes, KEHONG BIO provides custom synthesis services for BAS 00551898 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.