TL;DR: AT 2433-A1 (CAS 102644-20-2) is a chemical compound with molecular formula C34H35ClN4O9 and molecular weight 678.2092 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-chloro-3-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-[[(2S,4S,5S)-4-hydroxy-5-(methylamino)oxan-2-yl]oxymethyl]-5-methoxyoxan-2-yl]-13-methyl-3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1,4(9),5,7,10,15,17,19,21-nonaene-12,14-dione
Also Known As: AT2433-A1, AT 2433-A1, AT 2433 A1, J1.190.353C, 5-Chloro-3-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-[[(2S,4S,5S)-4-hydroxy-5-(methylamino)oxan-2-yl]oxymethyl]-5-methoxyoxan-2-yl]-13-methyl-3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1,4(9),5,7,10,15,17,19,21-nonaene-12,14-dione
| Molecular Formula | C34H35ClN4O9 |
| Molecular Weight | 678.2092 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 168.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 678.2092 Da |
| Heavy Atoms | 48 |
| Complexity | 1230.0 |
| SMILES | CN[C@H]1CO[C@H](C[C@@H]1O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)N3C4=C(C=CC=C4Cl)C5=C6C(=C7C8=CC=CC=C8NC7=C53)C(=O)N(C6=O)C)O)O)OC |
| InChIKey | CGQSZYLXZOKJEJ-VYCQBBBDSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AT 2433-A1. The TPSA of 168.0 Ų indicates high polarity, suggesting AT 2433-A1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AT 2433-A1 has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of AT 2433-A1 is 102644-20-2.
The molecular formula of AT 2433-A1 is C34H35ClN4O9.
The molecular weight of AT 2433-A1 is 678.2092 g/mol.
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