A3738/0158398
TL;DR: A3738/0158398 (CAS 727665-80-7) is a chemical compound with molecular formula C25H23N3O2 and molecular weight 397.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-(3-methylanilino)-12-(2-methylpropylamino)-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-8-one
Also Known As: A3738/0158398, 10-[(3-methylphenyl)amino]-12-[(2-methylpropyl)amino]-15-oxa-14-azatetracyclo[7.6.1.0^{2,7}.0^{13,16}]hexadeca-1(16),2(7),3,5,9,11,13-heptaen-8-one, 3-(isobutylamino)-5-(3-toluidino)-6H-anthra[1,9-cd]isoxazol-6-one, 5-[(3-methylphenyl)amino]-3-[(2-methylpropyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
| Molecular Formula | C25H23N3O2 |
|---|---|
| Molecular Weight | 397.18 g/mol |
| LogP | 6.15912 |
| Topological Polar Surface Area | 67.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.17902 |
| Heavy Atoms | 30 |
| Complexity | 1287.0435 |
Chemical Identifiers
| CAS Number | 727665-80-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC2=C3C4=C(C5=CC=CC=C5C3=O)ON=C4C(=C2)NCC(C)C |
Product Overview
A3738/0158398 (CAS 727665-80-7), with molecular formula C25H23N3O2 and molecular weight 397.18 g/mol. IUPAC: 10-(3-methylanilino)-12-(2-methylpropylamino)-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-8-one.
Chemical Property Profile of A3738/0158398
Property Insights of A3738/0158398
The XLogP value of 6.15912 indicates that A3738/0158398 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.16 Ų falls within the moderate polarity range, balancing permeability and solubility for A3738/0158398. Following Lipinski's Rule of Five, A3738/0158398 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3738/0158398?
The CAS number of A3738/0158398 is 727665-80-7.
What is the molecular formula of A3738/0158398?
The molecular formula of A3738/0158398 is C25H23N3O2.
What is the molecular weight of A3738/0158398?
The molecular weight of A3738/0158398 is 397.18 g/mol.
Where can I buy A3738/0158398?
You can request a quote for A3738/0158398 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3738/0158398?
Yes, KEHONG BIO provides custom synthesis services for A3738/0158398 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.