TL;DR: CID 1970 (CAS 152918-26-8) is a chemical compound with molecular formula C18H21N7O4 and molecular weight 399.1655 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
CID 1970
5-[6-[(4-aminophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide
Also Known As: AB-MECA, 5-[6-[(4-aminophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide, (2S,3S,4R,5R)-5-[6-[(4-aminophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide
| Molecular Formula | C18H21N7O4 |
| Molecular Weight | 399.1655 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 160.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.1655 Da |
| Heavy Atoms | 29 |
| Complexity | 576.0 |
| SMILES | CNC(=O)C1C(C(C(O1)N2C=NC3=C(N=CN=C32)NCC4=CC=C(C=C4)N)O)O |
| InChIKey | LDYMCRRFCMRFKB-UHFFFAOYSA-N |
The XLogP value of -0.4 indicates that CID 1970 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 160.0 Ų indicates high polarity, suggesting CID 1970 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CID 1970 has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of CID 1970 is 152918-26-8.
The molecular formula of CID 1970 is C18H21N7O4.
The molecular weight of CID 1970 is 399.1655 g/mol.
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