TL;DR: N,N-diethyl-5-isobutylthieno[2,3-d]pyrimidin-4-amine (CAS 342595-80-6) is a chemical compound with molecular formula C14H21N3S and molecular weight 263.14563 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-diethyl-5-(2-methylpropyl)thieno[2,3-d]pyrimidin-4-amine
Also Known As: N,N-diethyl-5-isobutylthieno[2,3-d]pyrimidin-4-amine, N,N-diethyl-5-(2-methylpropyl)thieno[2,3-d]pyrimidin-4-amine, AE-848/37296030
| Molecular Formula | C14H21N3S |
| Molecular Weight | 263.14563 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 57.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 263.14563 Da |
| Heavy Atoms | 18 |
| Complexity | 255.0 |
| SMILES | CCN(CC)C1=C2C(=CSC2=NC=N1)CC(C)C |
| InChIKey | QMTGUPSLHSAMOI-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that N,N-diethyl-5-isobutylthieno[2,3-d]pyrimidin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.3 Ų, N,N-diethyl-5-isobutylthieno[2,3-d]pyrimidin-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diethyl-5-isobutylthieno[2,3-d]pyrimidin-4-amine has 0 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 N,N-diethyl-5-isobutylthieno[2,3-d]pyrimidin-4-amine is 342595-80-6.
The molecular formula of N,N-diethyl-5-isobutylthieno[2,3-d]pyrimidin-4-amine is C14H21N3S.
The molecular weight of N,N-diethyl-5-isobutylthieno[2,3-d]pyrimidin-4-amine is 263.14563 g/mol.
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