Thiourea, N-(phenylmethyl)-N'-2-propenyl-
TL;DR: Thiourea, N-(phenylmethyl)-N'-2-propenyl- (CAS 4866-57-3) is a chemical compound with molecular formula C11H14N2S and molecular weight 206.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-prop-2-enylthiourea
Also Known As: 1-allyl-3-benzylthiourea, 1-benzyl-3-prop-2-enylthiourea, 1-allyl-3-benzyl thiourea, Thiourea, N-(phenylmethyl)-N'-2-propenyl-, N1.N3-Benzylallylthioharnstoff
| Molecular Formula | C11H14N2S |
|---|---|
| Molecular Weight | 206.09 g/mol |
| LogP | 1.8367 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.08777 |
| Heavy Atoms | 14 |
| Complexity | 295.41565 |
Chemical Identifiers
| CAS Number | 4866-57-3 |
|---|---|
| SMILES | C=CCNC(=S)NCC1=CC=CC=C1 |
Product Overview
Thiourea, N-(phenylmethyl)-N'-2-propenyl- (CAS 4866-57-3), with molecular formula C11H14N2S and molecular weight 206.09 g/mol. IUPAC: 1-benzyl-3-prop-2-enylthiourea.
Chemical Property Profile of Thiourea, N-(phenylmethyl)-N'-2-propenyl-
Property Insights of Thiourea, N-(phenylmethyl)-N'-2-propenyl-
The XLogP value of 1.8367 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiourea, N-(phenylmethyl)-N'-2-propenyl-. With a topological polar surface area (TPSA) of 24.06 Ų, Thiourea, N-(phenylmethyl)-N'-2-propenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiourea, N-(phenylmethyl)-N'-2-propenyl- has 2 hydrogen bond donor(s) and 1 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 Thiourea, N-(phenylmethyl)-N'-2-propenyl-?
The CAS number of Thiourea, N-(phenylmethyl)-N'-2-propenyl- is 4866-57-3.
What is the molecular formula of Thiourea, N-(phenylmethyl)-N'-2-propenyl-?
The molecular formula of Thiourea, N-(phenylmethyl)-N'-2-propenyl- is C11H14N2S.
What is the molecular weight of Thiourea, N-(phenylmethyl)-N'-2-propenyl-?
The molecular weight of Thiourea, N-(phenylmethyl)-N'-2-propenyl- is 206.09 g/mol.
Where can I buy Thiourea, N-(phenylmethyl)-N'-2-propenyl-?
You can request a quote for Thiourea, N-(phenylmethyl)-N'-2-propenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiourea, N-(phenylmethyl)-N'-2-propenyl-?
Yes, KEHONG BIO provides custom synthesis services for Thiourea, N-(phenylmethyl)-N'-2-propenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.