TL;DR: MT-DADMe-ImmA (CAS 1399840-35-7) is a chemical compound with molecular formula C13H19N5OS and molecular weight 293.13104 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-(methylsulfanylmethyl)pyrrolidin-3-ol
Also Known As: MT-DADMe-ImmA, MTDIA, DADMe-ImmA-Me, 1y6q, Methylthio-DADMe-Immucillin A
| Molecular Formula | C13H19N5OS |
| Molecular Weight | 293.13104 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.13104 Da |
| Heavy Atoms | 20 |
| Complexity | 334.0 |
| SMILES | CSC[C@H]1CN(C[C@@H]1O)CC2=CNC3=C2N=CN=C3N |
| InChIKey | NTHMDFGHOCNNOE-ZJUUUORDSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for MT-DADMe-ImmA. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for MT-DADMe-ImmA. Following Lipinski's Rule of Five, MT-DADMe-ImmA has 3 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 MT-DADMe-ImmA is 1399840-35-7.
The molecular formula of MT-DADMe-ImmA is C13H19N5OS.
The molecular weight of MT-DADMe-ImmA is 293.13104 g/mol.
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