TL;DR: Atevirdine Mesylate (CAS 138540-32-6) is a chemical compound with molecular formula C22H29N5O5S and molecular weight 475.18893 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-[3-(ethylamino)-2-pyridinyl]piperazin-1-yl]-(5-methoxy-1H-indol-2-yl)methanone;methanesulfonic acid
Also Known As: Atevirdine mesylate, Atevirdine, Atevirdine mesilate, Atevirdine mesylate [USAN], ATEVIRDINE SULPHATE
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C22H29N5O5S |
| Molecular Weight | 475.18893 g/mol |
| XLogP | 2.47 |
| Topological Polar Surface Area (TPSA) | 136.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 475.18893 Da |
| Heavy Atoms | 33 |
| Complexity | 617.0 |
| SMILES | CCNC1=C(N=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)OC.CS(=O)(=O)O |
| InChIKey | HKPKBPALSLUFFM-UHFFFAOYSA-N |
The XLogP value of 2.47 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Atevirdine Mesylate. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Atevirdine Mesylate. Following Lipinski's Rule of Five, Atevirdine Mesylate has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Atevirdine Mesylate is 138540-32-6.
The molecular formula of Atevirdine Mesylate is C22H29N5O5S.
The molecular weight of Atevirdine Mesylate is 475.18893 g/mol.
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