TL;DR: C.I.Vat Blue 41 (CAS 6371-38-6) is a chemical compound with molecular formula C16H6Cl4N2O2 and molecular weight 397.91833 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
C.I.Vat Blue 41
5,7-dichloro-2-(5,7-dichloro-3-hydroxy-1H-indol-2-yl)indol-3-one
Also Known As: C.I.Vat Blue 41, 5,7-Dichloro-2-(5,7-dichloro-1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,2-dihydro-3H-indol-3-one, C.I.73040, 5,7-dichloro-2-1,2-dihydro-3h-indol-3-one, delta2,2 -Bi[5,7-dichloroindoline-3-one]
| Molecular Formula | C16H6Cl4N2O2 |
| Molecular Weight | 397.91833 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 65.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 399.91537 Da |
| Heavy Atoms | 24 |
| Complexity | 574.0 |
| SMILES | C1=C(C=C(C2=C1C(=C(N2)C3=NC4=C(C3=O)C=C(C=C4Cl)Cl)O)Cl)Cl |
| InChIKey | DXTHDCZZUUAMPV-UHFFFAOYSA-N |
The XLogP value of 5.2 indicates that C.I.Vat Blue 41 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for C.I.Vat Blue 41. Following Lipinski's Rule of Five, C.I.Vat Blue 41 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of C.I.Vat Blue 41 is 6371-38-6.
The molecular formula of C.I.Vat Blue 41 is C16H6Cl4N2O2.
The molecular weight of C.I.Vat Blue 41 is 397.91833 g/mol.
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