TL;DR: 6-Aminochrysene (CAS 2642-98-0) is a chemical compound with molecular formula C18H13N and molecular weight 243.1048 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
chrysen-6-amine
Also Known As: 6-Chrysenamine, 6-AMINOCHRYSENE, chrysen-6-amine, Chrysenex, Chrysonex
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C18H13N |
| Molecular Weight | 243.1048 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 243.1048 Da |
| Heavy Atoms | 19 |
| Complexity | 326.0 |
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C=C(C4=CC=CC=C34)N |
| InChIKey | KIVUHCNVDWYUNP-UHFFFAOYSA-N |
The XLogP value of 5.0 indicates that 6-Aminochrysene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 6-Aminochrysene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Aminochrysene has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6-Aminochrysene is 2642-98-0.
The molecular formula of 6-Aminochrysene is C18H13N.
The molecular weight of 6-Aminochrysene is 243.1048 g/mol.
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