TL;DR: C21H19N3O5 (CAS 1212294-98-8) is a chemical compound with molecular formula C21H19N3O5 and molecular weight 393.13248 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methoxyethyl (3R)-6'-amino-5'-cyano-2'-methyl-2-oxo-1-prop-2-ynylspiro[indole-3,4'-pyran]-3'-carboxylate
Also Known As: (R)-2-methoxyethyl 2'-amino-3'-cyano-6'-methyl-2-oxo-1-(prop-2-yn-1-yl)spiro[indoline-3,4'-pyran]-5'-carboxylate
| Molecular Formula | C21H19N3O5 |
| Molecular Weight | 393.13248 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 393.13248 Da |
| Heavy Atoms | 29 |
| Complexity | 886.0 |
| SMILES | CC1=C([C@@]2(C3=CC=CC=C3N(C2=O)CC#C)C(=C(O1)N)C#N)C(=O)OCCOC |
| InChIKey | PWVASIYQVGHARU-OAQYLSRUSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C21H19N3O5. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C21H19N3O5. Following Lipinski's Rule of Five, C21H19N3O5 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of C21H19N3O5 is 1212294-98-8.
The molecular formula of C21H19N3O5 is C21H19N3O5.
The molecular weight of C21H19N3O5 is 393.13248 g/mol.
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