TL;DR: Carbamic acid, (2-nitronaphtho(2,1-b)furan-7-yl)-, methyl ester (CAS 125372-39-6) is a chemical compound with molecular formula C14H10N2O5 and molecular weight 286.05896 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl N-(2-nitrobenzo[e][1]benzofuran-7-yl)carbamate
Also Known As: Methyl (2-nitronaphtho(2,1-b)furan-7-yl)carbamate, Carbamic acid, (2-nitronaphtho(2,1-b)furan-7-yl)-, methyl ester, (2-Nitronaphtho(2,1-b)furan-7-yl)carbamic acid methyl ester, methyl N-(2-nitrobenzo[e][1]benzofuran-7-yl)carbamate, Methyl (2-nitronaphtho[2,1-b]furan-7-yl)carbamate
| Molecular Formula | C14H10N2O5 |
| Molecular Weight | 286.05896 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 97.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.05896 Da |
| Heavy Atoms | 21 |
| Complexity | 424.0 |
| SMILES | COC(=O)NC1=CC2=C(C=C1)C3=C(C=C2)OC(=C3)[N+](=O)[O-] |
| InChIKey | UTWSPKNURDBVPY-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that Carbamic acid, (2-nitronaphtho(2,1-b)furan-7-yl)-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, (2-nitronaphtho(2,1-b)furan-7-yl)-, methyl ester. Following Lipinski's Rule of Five, Carbamic acid, (2-nitronaphtho(2,1-b)furan-7-yl)-, methyl ester has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Carbamic acid, (2-nitronaphtho(2,1-b)furan-7-yl)-, methyl ester is 125372-39-6.
The molecular formula of Carbamic acid, (2-nitronaphtho(2,1-b)furan-7-yl)-, methyl ester is C14H10N2O5.
The molecular weight of Carbamic acid, (2-nitronaphtho(2,1-b)furan-7-yl)-, methyl ester is 286.05896 g/mol.
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