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二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物
TL;DR: 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物 (CAS 125276-72-4) is a chemical compound with molecular formula C21H15NO3 and molecular weight 329.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物
(16R,18S,19S,20R)-17-oxa-2-azahexacyclo[12.9.0.03,12.04,9.015,21.016,18]tricosa-1(14),2,4,6,8,10,12,15(21),22-nonaene-19,20-diol
Also Known As: Dibenz(a,h)acridine 3,4-diol-1,2-epoxide, ( /-)-anti-Dibenz(a,h)acridine 3,4-diol-1,2-epoxide, (+/-)-anti-Dibenz(a,h)acridine 3,4-diol-1,2-epoxide, Benz(h)oxireno(5,6)benz(1,2-a)acridine-2,3-diol, 1a,2,3,13c-tetrahydro-, (1a-alpha,2-beta,3-alpha,13c-alpha)-(+-)-
| Molecular Formula | C21H15NO3 |
|---|---|
| Molecular Weight | 329.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 65.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 329.1052 |
| Heavy Atoms | 25 |
| Complexity | 541.0 |
Chemical Identifiers
| CAS Number | 125276-72-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=CC4=C(C=CC5=C4[C@@H]6[C@@H](O6)[C@H]([C@@H]5O)O)N=C32 |
| InChIKey | XPMBTWVVTCOLCP-MHTWAQMVSA-N |
Product Overview
二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物 (CAS 125276-72-4), with molecular formula C21H15NO3 and molecular weight 329.11 g/mol. IUPAC: (16R,18S,19S,20R)-17-oxa-2-azahexacyclo[12.9.0.03,12.04,9.015,21.016,18]tricosa-1(14),2,4,6,8,10,12,15(21),22-nonaene-19,20-diol.
Chemical Property Profile of 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物
Property Insights of 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物. The TPSA of 65.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物. Following Lipinski's Rule of Five, 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物 has 2 hydrogen bond donor(s) and 4 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 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物?
The CAS number of 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物 is 125276-72-4.
What is the molecular formula of 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物?
The molecular formula of 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物 is C21H15NO3.
What is the molecular weight of 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物?
The molecular weight of 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物 is 329.11 g/mol.
Where can I buy 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物?
You can request a quote for 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物?
Yes, KEHONG BIO provides custom synthesis services for 二苯并[a,h]吖啶3,4-二醇-1,2-环氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.