TL;DR: AJ-292/14921056 (CAS 306287-61-6) is a chemical compound with molecular formula C25H29N3O2S and molecular weight 435.19806 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-ethyl-6-(4-methoxyphenyl)-9,9-dimethyl-7-oxo-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepine-5-carbothioamide
Also Known As: AJ-292/14921056, N-ethyl-6-(4-methoxyphenyl)-9,9-dimethyl-7-oxo-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepine-5-carbothioamide, N-ethyl-11-(4-methoxyphenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carbothioamide, N-ethyl-11-(4-methoxyphenyl)-3,3-dimethyl-1-oxo-3,4,5,11-tetrahydro-1H-dibenzo[b,e][1,4]diazepine-10(2H)-carbothioamide
| Molecular Formula | C25H29N3O2S |
| Molecular Weight | 435.19806 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 85.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 435.19806 Da |
| Heavy Atoms | 31 |
| Complexity | 726.0 |
| SMILES | CCNC(=S)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC=C(C=C4)OC |
| InChIKey | QVVUBRKUPNRMHT-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that AJ-292/14921056 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.7 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-292/14921056. Following Lipinski's Rule of Five, AJ-292/14921056 has 2 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 AJ-292/14921056 is 306287-61-6.
The molecular formula of AJ-292/14921056 is C25H29N3O2S.
The molecular weight of AJ-292/14921056 is 435.19806 g/mol.
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