TL;DR: ASN 04936476 (CAS 1033076-94-6) is a chemical compound with molecular formula C32H33FN4O3S and molecular weight 572.22577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-N-[2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-(2,3-dimethylphenyl)-3-(4-fluorophenyl)-1,2-thiazole-5-carboxamide
Also Known As: ASN 04936476, 4-amino-N-[(1S)-2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-(2,3-dimethylphenyl)-3-(4-fluorophenyl)-1,2-thiazole-5-carboxamide, 4-amino-N-[2-(cyclopentylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-(2,3-dimethylphenyl)-3-(4-fluorophenyl)-1,2-thiazole-5-carboxamide
| Molecular Formula | C32H33FN4O3S |
| Molecular Weight | 572.22577 g/mol |
| XLogP | 7.0 |
| Topological Polar Surface Area (TPSA) | 126.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 572.22577 Da |
| Heavy Atoms | 41 |
| Complexity | 875.0 |
| SMILES | CC1=C(C(=CC=C1)N(C(C2=CC=C(C=C2)OC)C(=O)NC3CCCC3)C(=O)C4=C(C(=NS4)C5=CC=C(C=C5)F)N)C |
| InChIKey | LKFCAZRPZGPOPT-UHFFFAOYSA-N |
The XLogP value of 7.0 indicates that ASN 04936476 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 04936476. Following Lipinski's Rule of Five, ASN 04936476 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of ASN 04936476 is 1033076-94-6.
The molecular formula of ASN 04936476 is C32H33FN4O3S.
The molecular weight of ASN 04936476 is 572.22577 g/mol.
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