ChemDiv1_006152
TL;DR: ChemDiv1_006152 (CAS 315672-31-2) is a chemical compound with molecular formula C26H25N3O2 and molecular weight 411.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(9-ethylcarbazol-3-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile
Also Known As: ChemDiv1_006152, 2-Amino-4-(9-ethyl-9H-carbazol-3-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, BAS 02228843, AB00140437-02, F1443-6582
| Molecular Formula | C26H25N3O2 |
|---|---|
| Molecular Weight | 411.19 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 81.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 411.19467 |
| Heavy Atoms | 31 |
| Complexity | 892.0 |
Chemical Identifiers
| CAS Number | 315672-31-2 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2)C3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N)C5=CC=CC=C51 |
| InChIKey | SGHQQMUDNRLWQA-UHFFFAOYSA-N |
Product Overview
ChemDiv1_006152 (CAS 315672-31-2), with molecular formula C26H25N3O2 and molecular weight 411.19 g/mol. IUPAC: 2-amino-4-(9-ethylcarbazol-3-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile.
Chemical Property Profile of ChemDiv1_006152
Property Insights of ChemDiv1_006152
The XLogP value of 4.5 indicates that ChemDiv1_006152 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_006152. Following Lipinski's Rule of Five, ChemDiv1_006152 has 1 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 ChemDiv1_006152?
The CAS number of ChemDiv1_006152 is 315672-31-2.
What is the molecular formula of ChemDiv1_006152?
The molecular formula of ChemDiv1_006152 is C26H25N3O2.
What is the molecular weight of ChemDiv1_006152?
The molecular weight of ChemDiv1_006152 is 411.19 g/mol.
Where can I buy ChemDiv1_006152?
You can request a quote for ChemDiv1_006152 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_006152?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_006152 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.