RefChem:240978
TL;DR: RefChem:240978 (CAS 68834-07-1) is a chemical compound with molecular formula C33H38N8O9 and molecular weight 690.2762 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
14-[[[4,6-bis[bis(methoxymethyl)amino]-1,3,5-triazin-2-yl]-(methoxymethyl)amino]methylamino]-4-methoxy-8-oxa-14-azapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,9,11,16(20),17-octaene-13,15-dione
Also Known As: 1H-Xantheno[2,1,9-def]isoquinoline-1,3(2H)-dione, 2-[[[[4,6-bis[bis(methoxymethyl)amino]-1,3,5-triazin-2-yl](methoxymethyl)amino]methyl]amino]-9-methoxy-, 2-((((4,6-Bis(bis(methoxymethyl)amino)-1,3,5-triazin-2-yl)(methoxymethyl)amino)methyl)amino)-9-methoxy-1H-xantheno(2,1,9-def)isoquinoline-1,3(2H)-dione, 1H-Xantheno(2,1,9-def)isoquinoline-1,3(2H)-dione, 2-((((4,6-bis(bis(methoxymethyl)amino)-1,3,5-triazin-2-yl)(methoxymethyl)amino)methyl)amino)-9-methoxy-, 2-[[[[4,6-Bis[bis(methoxymethyl)amino]-1,3,5-triazin-2-yl](methoxymethyl)amino]methyl]amino]-9-methoxy-1H-xantheno[2,1,9-def]isoquinoline-1,3(2H)-dione, Pentaerythritol, mixed esters with valeric acid, caprylic acid, capric acid
Technical Specifications
| Molecular Formula | C33H38N8O9 |
| Molecular Weight | 690.2762 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 162.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 17 |
| Exact Mass | 690.2762 Da |
| Heavy Atoms | 50 |
| Complexity | 1090.0 |
| SMILES | COCN(CNN1C(=O)C2=C3C(=CC=C4C3=C(C=C2)C5=C(O4)C=CC(=C5)OC)C1=O)C6=NC(=NC(=N6)N(COC)COC)N(COC)COC |
| InChIKey | MNURKULVBXOAGD-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:240978
Property Insights of RefChem:240978
The XLogP value of 4.1 indicates that RefChem:240978 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 162.0 Ų indicates high polarity, suggesting RefChem:240978 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:240978 has 1 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:240978?
The CAS number of RefChem:240978 is 68834-07-1.
What is the molecular formula of RefChem:240978?
The molecular formula of RefChem:240978 is C33H38N8O9.
What is the molecular weight of RefChem:240978?
The molecular weight of RefChem:240978 is 690.2762 g/mol.
Where can I buy RefChem:240978?
You can request a quote for RefChem:240978 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:240978?
Yes, CoreyChem provides custom synthesis services for RefChem:240978 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.