Semicarbazide, 4-allyl-1-phenyl-3-thio-
TL;DR: Semicarbazide, 4-allyl-1-phenyl-3-thio- (CAS 27421-87-0) is a chemical compound with molecular formula C10H13N3S and molecular weight 207.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-anilino-3-prop-2-enylthiourea
Also Known As: NCIOpen2_004464, Semicarbazide, 4-allyl-1-phenyl-3-thio-, 4-Allyl-1-phenyl-3-thiosemicarbazide, 1-anilino-3-prop-2-enylthiourea, 1-Phenyl-4-allylthiosemicarbazide
| Molecular Formula | C10H13N3S |
|---|---|
| Molecular Weight | 207.08 g/mol |
| LogP | 1.6636 |
| Topological Polar Surface Area | 36.09 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 207.08302 |
| Heavy Atoms | 14 |
| Complexity | 297.49524 |
Chemical Identifiers
| CAS Number | 27421-87-0 |
|---|---|
| SMILES | C=CCNC(=S)NNC1=CC=CC=C1 |
Product Overview
Semicarbazide, 4-allyl-1-phenyl-3-thio- (CAS 27421-87-0), with molecular formula C10H13N3S and molecular weight 207.08 g/mol. IUPAC: 1-anilino-3-prop-2-enylthiourea.
Chemical Property Profile of Semicarbazide, 4-allyl-1-phenyl-3-thio-
Property Insights of Semicarbazide, 4-allyl-1-phenyl-3-thio-
The XLogP value of 1.6636 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Semicarbazide, 4-allyl-1-phenyl-3-thio-. With a topological polar surface area (TPSA) of 36.09 Ų, Semicarbazide, 4-allyl-1-phenyl-3-thio- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Semicarbazide, 4-allyl-1-phenyl-3-thio- has 3 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 Semicarbazide, 4-allyl-1-phenyl-3-thio-?
The CAS number of Semicarbazide, 4-allyl-1-phenyl-3-thio- is 27421-87-0.
What is the molecular formula of Semicarbazide, 4-allyl-1-phenyl-3-thio-?
The molecular formula of Semicarbazide, 4-allyl-1-phenyl-3-thio- is C10H13N3S.
What is the molecular weight of Semicarbazide, 4-allyl-1-phenyl-3-thio-?
The molecular weight of Semicarbazide, 4-allyl-1-phenyl-3-thio- is 207.08 g/mol.
Where can I buy Semicarbazide, 4-allyl-1-phenyl-3-thio-?
You can request a quote for Semicarbazide, 4-allyl-1-phenyl-3-thio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Semicarbazide, 4-allyl-1-phenyl-3-thio-?
Yes, KEHONG BIO provides custom synthesis services for Semicarbazide, 4-allyl-1-phenyl-3-thio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.