AB01301894-01
TL;DR: AB01301894-01 (CAS 879472-02-3) is a chemical compound with molecular formula C27H23N3O5 and molecular weight 469.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-8-(4-methylphenyl)-13-(4-oxochromen-3-yl)-12-oxa-3,5,9-triazatricyclo[7.4.0.02,7]trideca-1,7-diene-4,6-dione
Also Known As: AB01301894-01, 1,3-dimethyl-5-(4-methylphenyl)-10-(4-oxo-4H-chromen-3-yl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione, 1,3-dimethyl-10-(4-oxo-4H-chromen-3-yl)-5-(p-tolyl)-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione
| Molecular Formula | C27H23N3O5 |
|---|---|
| Molecular Weight | 469.16 g/mol |
| LogP | 3.24012 |
| Topological Polar Surface Area | 88.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 469.16376 |
| Heavy Atoms | 35 |
| Complexity | 1819.5516 |
Chemical Identifiers
| CAS Number | 879472-02-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=C3C(=C4N2CCOC4C5=COC6=CC=CC=C6C5=O)N(C(=O)N(C3=O)C)C |
Product Overview
AB01301894-01 (CAS 879472-02-3), with molecular formula C27H23N3O5 and molecular weight 469.16 g/mol. IUPAC: 3,5-dimethyl-8-(4-methylphenyl)-13-(4-oxochromen-3-yl)-12-oxa-3,5,9-triazatricyclo[7.4.0.02,7]trideca-1,7-diene-4,6-dione.
Chemical Property Profile of AB01301894-01
Property Insights of AB01301894-01
The XLogP value of 3.24012 indicates that AB01301894-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.37 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01301894-01. Following Lipinski's Rule of Five, AB01301894-01 has 0 hydrogen bond donor(s) and 5 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 AB01301894-01?
The CAS number of AB01301894-01 is 879472-02-3.
What is the molecular formula of AB01301894-01?
The molecular formula of AB01301894-01 is C27H23N3O5.
What is the molecular weight of AB01301894-01?
The molecular weight of AB01301894-01 is 469.16 g/mol.
Where can I buy AB01301894-01?
You can request a quote for AB01301894-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01301894-01?
Yes, KEHONG BIO provides custom synthesis services for AB01301894-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.