(1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine
TL;DR: (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine (CAS 93780-95-1) 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.
(18R,19S,20S,22R)-21-oxa-2-azahexacyclo[12.9.0.03,12.04,9.017,23.020,22]tricosa-1(14),2,4,6,8,10,12,15,17(23)-nonaene-18,19-diol
Also Known As: J1.454.927G, (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine, (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrobenz(c,h)acridine, Benz(c)oxireno(5,6)benz(1,2-h)acridine-2,3-diol, 1a,2,3,13c-tetrahydro-, (1aS-(1a-alpha,2-beta,3-alpha,13c-alpha))-, (1aS,2S,3R,13cR)-1a,2,3,13c-Tetrahydrobenz[c]oxireno[5,6]benz[1,2-h]acridine-2,3-diol
| 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 | 93780-95-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=CC4=C(C5=C(C=C4)[C@H]([C@@H]([C@H]6[C@@H]5O6)O)O)N=C32 |
| InChIKey | BXJBQIRUMHGZCB-MHTWAQMVSA-N |
Product Overview
(1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine (CAS 93780-95-1), with molecular formula C21H15NO3 and molecular weight 329.11 g/mol. IUPAC: (18R,19S,20S,22R)-21-oxa-2-azahexacyclo[12.9.0.03,12.04,9.017,23.020,22]tricosa-1(14),2,4,6,8,10,12,15,17(23)-nonaene-18,19-diol.
Chemical Property Profile of (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine
Property Insights of (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine. The TPSA of 65.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine. Following Lipinski's Rule of Five, (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine 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 (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine?
The CAS number of (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine is 93780-95-1.
What is the molecular formula of (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine?
The molecular formula of (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine is C21H15NO3.
What is the molecular weight of (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine?
The molecular weight of (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine is 329.11 g/mol.
Where can I buy (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine?
You can request a quote for (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine?
Yes, KEHONG BIO provides custom synthesis services for (1R,2S,3S,4R)-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrodibenz(c,h)acridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.