MixCom6_002615
TL;DR: MixCom6_002615 (CAS 297159-71-8) is a chemical compound with molecular formula C35H34N2O5 and molecular weight 562.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(3,4-dimethoxyphenyl)-6-(3-methoxy-4-phenylmethoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: MixCom6_002615, BIM-0047566.P001, A2358/0099606, 11-[4-(benzyloxy)-3-methoxyphenyl]-3-(3,4-dimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 9-(3,4-dimethoxyphenyl)-6-(3-methoxy-4-phenylmethoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
| Molecular Formula | C35H34N2O5 |
|---|---|
| Molecular Weight | 562.25 g/mol |
| LogP | 7.2709 |
| Topological Polar Surface Area | 78.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 562.24677 |
| Heavy Atoms | 42 |
| Complexity | 1631.9581 |
Chemical Identifiers
| CAS Number | 297159-71-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC(=C(C=C5)OCC6=CC=CC=C6)OC)C(=O)C2)OC |
Product Overview
MixCom6_002615 (CAS 297159-71-8), with molecular formula C35H34N2O5 and molecular weight 562.25 g/mol. IUPAC: 9-(3,4-dimethoxyphenyl)-6-(3-methoxy-4-phenylmethoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of MixCom6_002615
Property Insights of MixCom6_002615
The XLogP value of 7.2709 indicates that MixCom6_002615 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.05 Ų falls within the moderate polarity range, balancing permeability and solubility for MixCom6_002615. Following Lipinski's Rule of Five, MixCom6_002615 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of MixCom6_002615?
The CAS number of MixCom6_002615 is 297159-71-8.
What is the molecular formula of MixCom6_002615?
The molecular formula of MixCom6_002615 is C35H34N2O5.
What is the molecular weight of MixCom6_002615?
The molecular weight of MixCom6_002615 is 562.25 g/mol.
Where can I buy MixCom6_002615?
You can request a quote for MixCom6_002615 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MixCom6_002615?
Yes, KEHONG BIO provides custom synthesis services for MixCom6_002615 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.