Grossularine 1
TL;DR: Grossularine 1 (CAS 94935-97-4) is a chemical compound with molecular formula C23H18N6O and molecular weight 394.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[10-amino-14-(dimethylamino)-8,13,15-triazatetracyclo[7.6.0.02,7.011,15]pentadeca-1,3,5,7,9,11,13-heptaen-12-yl]-(1H-indol-3-yl)methanone
Also Known As: Grossularine 1, Grossularine, [10-amino-14-(dimethylamino)-8,13,15-triazatetracyclo[7.6.0.02,7.011,15]pentadeca-1,3,5,7,9,11,13-heptaen-12-yl]-(1H-indol-3-yl)methanone, (10-amino-14-(dimethylamino)-8,13,15-triazatetracyclo(7.6.0.02,7.011,15)pentadeca-1,3,5,7,9,11,13-heptaen-12-yl)-(1H-indol-3-yl)methanone, [10-Amino-3-(dimethylamino)imidazo[1',5':1,5]pyrrolo[3,2-b]indol-1-yl](1H-indol-3-yl)methanone
| Molecular Formula | C23H18N6O |
|---|---|
| Molecular Weight | 394.15 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 92.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 394.1542 |
| Heavy Atoms | 30 |
| Complexity | 957.0 |
Chemical Identifiers
| CAS Number | 94935-97-4 |
|---|---|
| SMILES | CN(C)C1=NC(=C2N1C3=C4C=CC=CC4=NC3=C2N)C(=O)C5=CNC6=CC=CC=C65 |
| InChIKey | FCNJUPUMHGDABC-UHFFFAOYSA-N |
Product Overview
Grossularine 1 (CAS 94935-97-4), with molecular formula C23H18N6O and molecular weight 394.15 g/mol. IUPAC: [10-amino-14-(dimethylamino)-8,13,15-triazatetracyclo[7.6.0.02,7.011,15]pentadeca-1,3,5,7,9,11,13-heptaen-12-yl]-(1H-indol-3-yl)methanone.
Chemical Property Profile of Grossularine 1
Property Insights of Grossularine 1
The XLogP value of 4.1 indicates that Grossularine 1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Grossularine 1. Following Lipinski's Rule of Five, Grossularine 1 has 2 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 Grossularine 1?
The CAS number of Grossularine 1 is 94935-97-4.
What is the molecular formula of Grossularine 1?
The molecular formula of Grossularine 1 is C23H18N6O.
What is the molecular weight of Grossularine 1?
The molecular weight of Grossularine 1 is 394.15 g/mol.
Where can I buy Grossularine 1?
You can request a quote for Grossularine 1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Grossularine 1?
Yes, KEHONG BIO provides custom synthesis services for Grossularine 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.