C31H30N4O6
TL;DR: C31H30N4O6 (CAS 956204-90-3) is a chemical compound with molecular formula C31H30N4O6 and molecular weight 554.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2,4-dimethoxyphenyl)methyl]-2-[(2S)-12-methoxy-2-methyl-3,5-dioxo-4,6,16-triazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),10(15),11,13-tetraen-4-yl]benzamide
Also Known As: (S)-N-(2,4-dimethoxybenzyl)-2-(8-methoxy-11b-methyl-1,3-dioxo-5,6-dihydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H,11H,11bH)-yl)benzamide, N-(2,4-dimethoxybenzyl)-2-[(11bS)-8-methoxy-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]benzamide
| Molecular Formula | C31H30N4O6 |
|---|---|
| Molecular Weight | 554.22 g/mol |
| LogP | 4.3638 |
| Topological Polar Surface Area | 113.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 554.21655 |
| Heavy Atoms | 41 |
| Complexity | 1712.2539 |
Chemical Identifiers
| CAS Number | 956204-90-3 |
|---|---|
| SMILES | C[C@@]12C3=C(CCN1C(=O)N(C2=O)C4=CC=CC=C4C(=O)NCC5=C(C=C(C=C5)OC)OC)C6=C(N3)C=CC(=C6)OC |
Product Overview
C31H30N4O6 (CAS 956204-90-3), with molecular formula C31H30N4O6 and molecular weight 554.22 g/mol. IUPAC: N-[(2,4-dimethoxyphenyl)methyl]-2-[(2S)-12-methoxy-2-methyl-3,5-dioxo-4,6,16-triazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),10(15),11,13-tetraen-4-yl]benzamide.
Chemical Property Profile of C31H30N4O6
Property Insights of C31H30N4O6
The XLogP value of 4.3638 indicates that C31H30N4O6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.2 Ų falls within the moderate polarity range, balancing permeability and solubility for C31H30N4O6. Following Lipinski's Rule of Five, C31H30N4O6 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C31H30N4O6?
The CAS number of C31H30N4O6 is 956204-90-3.
What is the molecular formula of C31H30N4O6?
The molecular formula of C31H30N4O6 is C31H30N4O6.
What is the molecular weight of C31H30N4O6?
The molecular weight of C31H30N4O6 is 554.22 g/mol.
Where can I buy C31H30N4O6?
You can request a quote for C31H30N4O6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C31H30N4O6?
Yes, KEHONG BIO provides custom synthesis services for C31H30N4O6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.