4-amino-1,2,5-thiadiazole-3-carboxylic acid - CAS 2829-58-5
Catalog: |
BB019803 |
Product Name: |
4-amino-1,2,5-thiadiazole-3-carboxylic acid |
CAS: |
2829-58-5 |
Synonyms: |
4-amino-1,2,5-thiadiazole-3-carboxylic acid; 4-amino-1,2,5-thiadiazole-3-carboxylic acid |
IUPAC Name: | 4-amino-1,2,5-thiadiazole-3-carboxylic acid |
Description: | 4-amino-1,2,5-thiadiazole-3-carboxylic acid (CAS# 2829-58-5) is a useful research chemical. |
Molecular Weight: | 145.136 |
Molecular Formula: | C3H3N3O2S |
Canonical SMILES: | C1(=NSN=C1N)C(=O)O |
InChI: | InChI=1S/C3H3N3O2S/c4-2-1(3(7)8)5-9-6-2/h(H2,4,6)(H,7,8) |
InChI Key: | OJMKAQZLZNNVTG-UHFFFAOYSA-N |
Boiling Point: | 374.6 ℃ at 760 mmHg |
Density: | 1.81 g/cm3 |
MDL: | MFCD00718830 |
LogP: | 0.39970 |
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-2021323960-A1 | Fused tri-cyclic compound as pde3/pde4 dual inhibitor | 20180713 |
EP-3535259-A1 | Substituted n-hydroxyamidinoheterocycles as modulators of indoleamine 2,3- dioxygenase | 20161103 |
TW-201819362-A | Substituted N-hydroxyformamido heterocyclic compound as a guanamine 2,3-dioxygen modulator | 20161103 |
US-2019292160-A1 | Substituted n-hydroxyamidinoheterocycles as modulators of indoleamine 2,3-dioxygenase | 20161103 |
WO-2018083241-A1 | Substituted n-hydroxyamidinoheterocycles as modulators of indoleamine 2,3- dioxygenase | 20161103 |
Complexity: | 130 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 144.99459752 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 144.99459752 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 117 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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