S-[(2-Guanidino-4-thiazoyl)methyl] isothiourea hydrochloride - CAS 352530-51-9
Catalog: |
BB022569 |
Product Name: |
S-[(2-Guanidino-4-thiazoyl)methyl] isothiourea hydrochloride |
CAS: |
352530-51-9 |
Synonyms: |
2-[4-[(aminosulfinimidoyl)methyl]-1,3-thiazol-2-yl]guanidine;hydrochloride |
IUPAC Name: | 2-[4-[(aminosulfinimidoyl)methyl]-1,3-thiazol-2-yl]guanidine;hydrochloride |
Description: | S-[(2-Guanidino-4-thiazoyl)methyl] isothiourea hydrochloride (CAS# 352530-51-9 ) is a useful research chemical. |
Molecular Weight: | 254.76 |
Molecular Formula: | C5H10N6S2 · HCl |
Canonical SMILES: | C1=C(N=C(S1)N=C(N)N)CS(=N)N.Cl |
InChI: | InChI=1S/C5H10N6S2.ClH/c6-4(7)11-5-10-3(1-12-5)2-13(8)9;/h1H,2H2,(H3,8,9)(H4,6,7,10,11);1H |
InChI Key: | VMTBAWMHJSRIIP-UHFFFAOYSA-N |
MDL: | MFCD00792474 |
LogP: | 3.32850 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2011143340-A1 | Non-invasive isolation of fetal nucleic acid | 20071101 |
WO-2009058997-A2 | Non-invasive isolation of fetal nucleic acid | 20071101 |
Complexity: | 225 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 254.0175144 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 5 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 254.0175144 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 175 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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