TL;DR: Thiourea, bis(1-methyl-2-pyrrolidinylidene)- (CAS 126826-78-6) is a chemical compound with molecular formula C11H18N4S and molecular weight 238.12521 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1',7-dimethylspiro[3,4a,5,6-tetrahydropyrrolo[2,3-d]pyrimidine-4,2'-pyrrolidine]-2-thione
Also Known As: Thiourea, bis(1-methyl-2-pyrrolidinylidene)-, N,N-Bis(1-methyl-2-pyrrolidinylidene)thiourea, 1',7-dimethylspiro[3,4a,5,6-tetrahydropyrrolo[2,3-d]pyrimidine-4,2'-pyrrolidine]-2-thione, 1,7'-Dimethyl-4'a,5',6',7'-tetrahydrospiro[pyrrolidine-2,4'-pyrrolo[2,3-d]pyrimidine]-2'-thiol
| Molecular Formula | C11H18N4S |
| Molecular Weight | 238.12521 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 63.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 238.12521 Da |
| Heavy Atoms | 16 |
| Complexity | 367.0 |
| SMILES | CN1CCC2C1=NC(=S)NC23CCCN3C |
| InChIKey | NCBUHRJRBXZJBD-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiourea, bis(1-methyl-2-pyrrolidinylidene)-. The TPSA of 63.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiourea, bis(1-methyl-2-pyrrolidinylidene)-. Following Lipinski's Rule of Five, Thiourea, bis(1-methyl-2-pyrrolidinylidene)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Thiourea, bis(1-methyl-2-pyrrolidinylidene)- is 126826-78-6.
The molecular formula of Thiourea, bis(1-methyl-2-pyrrolidinylidene)- is C11H18N4S.
The molecular weight of Thiourea, bis(1-methyl-2-pyrrolidinylidene)- is 238.12521 g/mol.
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