TL;DR: Butanamide, 4-(((methyl-aci-nitro)acetyl)amino)- (CAS 102692-05-7) is a chemical compound with molecular formula C7H13N3O4 and molecular weight 203.0906 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(4-amino-4-oxobutyl)amino]-N-methoxy-2-oxoethanimine oxide
Also Known As: YN 0165 JA, YN-0165J-A, Butanamide, 4-(((methyl-aci-nitro)acetyl)amino)-, 2-[(4-amino-4-oxobutyl)amino]-N-methoxy-2-oxoethanimine oxide
| Molecular Formula | C7H13N3O4 |
| Molecular Weight | 203.0906 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 203.0906 Da |
| Heavy Atoms | 14 |
| Complexity | 239.0 |
| SMILES | CO[N+](=CC(=O)NCCCC(=O)N)[O-] |
| InChIKey | YLQMBRMHBUNQCQ-UHFFFAOYSA-N |
The XLogP value of -0.8 indicates that Butanamide, 4-(((methyl-aci-nitro)acetyl)amino)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanamide, 4-(((methyl-aci-nitro)acetyl)amino)-. Following Lipinski's Rule of Five, Butanamide, 4-(((methyl-aci-nitro)acetyl)amino)- has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Butanamide, 4-(((methyl-aci-nitro)acetyl)amino)- is 102692-05-7.
The molecular formula of Butanamide, 4-(((methyl-aci-nitro)acetyl)amino)- is C7H13N3O4.
The molecular weight of Butanamide, 4-(((methyl-aci-nitro)acetyl)amino)- is 203.0906 g/mol.
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