TL;DR: 4-Morpholineethanamine, N-(2-nitro-3-thienyl)-, monohydrochloride (CAS 122777-90-6) is a chemical compound with molecular formula C10H16ClN3O3S and molecular weight 293.0601 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-morpholin-4-ylethyl)-2-nitrothiophen-3-amine;hydrochloride
Also Known As: 4-Morpholineethanamine, N-(2-nitro-3-thienyl)-, monohydrochloride, N-(2-Nitro-3-thienyl)-4-morpholineethanamine monohydrochloride, N-(2-morpholin-4-ylethyl)-2-nitro-thiophen-3-amine hydrochloride, N-(2-morpholin-4-ylethyl)-2-nitrothiophen-3-amine;hydrochloride, N-(2-morpholin-4-ylethyl)-2-nitrothiophen-3-amine hydrochloride
| Molecular Formula | C10H16ClN3O3S |
| Molecular Weight | 293.0601 g/mol |
| XLogP | 1.8222 |
| Topological Polar Surface Area (TPSA) | 98.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.0601 Da |
| Heavy Atoms | 18 |
| Complexity | 256.0 |
| SMILES | C1COCCN1CCNC2=C(SC=C2)[N+](=O)[O-].Cl |
| InChIKey | CREBSLCZIXYLBD-UHFFFAOYSA-N |
The XLogP value of 1.8222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Morpholineethanamine, N-(2-nitro-3-thienyl)-, monohydrochloride. The TPSA of 98.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Morpholineethanamine, N-(2-nitro-3-thienyl)-, monohydrochloride. Following Lipinski's Rule of Five, 4-Morpholineethanamine, N-(2-nitro-3-thienyl)-, monohydrochloride has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Morpholineethanamine, N-(2-nitro-3-thienyl)-, monohydrochloride is 122777-90-6.
The molecular formula of 4-Morpholineethanamine, N-(2-nitro-3-thienyl)-, monohydrochloride is C10H16ClN3O3S.
The molecular weight of 4-Morpholineethanamine, N-(2-nitro-3-thienyl)-, monohydrochloride is 293.0601 g/mol.
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