PTH-L-proline
TL;DR: PTH-L-proline (CAS 29635-99-2) is a chemical compound with molecular formula C12H12N2OS and molecular weight 232.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7aS)-2-phenyl-3-sulfanylidene-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazol-1-one
Also Known As: PTH-L-proline, (7aS)-2-phenyl-3-sulfanylidene-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazol-1-one, (7aS)-2-phenyl-3-sulfanylidene-hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one, (S)-2-phenyl-3-thioxohexahydro-1H-pyrrolo[1,2-c]imidazol-1-one, (7aS)-2-Phenyl-3-sulfanylidenehexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
| Molecular Formula | C12H12N2OS |
|---|---|
| Molecular Weight | 232.07 g/mol |
| LogP | 1.7825 |
| Topological Polar Surface Area | 23.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 232.06703 |
| Heavy Atoms | 16 |
| Complexity | 423.5918 |
Chemical Identifiers
| CAS Number | 29635-99-2 |
|---|---|
| SMILES | C1C[C@H]2C(=O)N(C(=S)N2C1)C3=CC=CC=C3 |
Product Overview
PTH-L-proline (CAS 29635-99-2), with molecular formula C12H12N2OS and molecular weight 232.07 g/mol. IUPAC: (7aS)-2-phenyl-3-sulfanylidene-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazol-1-one.
Chemical Property Profile of PTH-L-proline
Property Insights of PTH-L-proline
The XLogP value of 1.7825 suggests moderate lipophilicity, balancing water solubility and membrane permeability for PTH-L-proline. With a topological polar surface area (TPSA) of 23.55 Ų, PTH-L-proline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, PTH-L-proline has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of PTH-L-proline?
The CAS number of PTH-L-proline is 29635-99-2.
What is the molecular formula of PTH-L-proline?
The molecular formula of PTH-L-proline is C12H12N2OS.
What is the molecular weight of PTH-L-proline?
The molecular weight of PTH-L-proline is 232.07 g/mol.
Where can I buy PTH-L-proline?
You can request a quote for PTH-L-proline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PTH-L-proline?
Yes, KEHONG BIO provides custom synthesis services for PTH-L-proline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.