CS-1001491
6-Chloro-5-(2,3-dichlorophenoxy)-1-methyl-2-(methylthio)-1H-benzimidazole
Manufacturer: ChemScene
CAS Number: 145770-89-4
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₅H₁₁Cl₃N₂OS
Molecular Weight
373.68
Synonyms
None
SMILES
ClC1=CC=CC(OC2=CC=3N=C(SC)N(C3C=C2Cl)C)=C1Cl
Tpsa
27.05
Logp
6.0477
H Acceptors
4
H Donors
0
Rotatable Bonds
3
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₁Cl₃N₂OS
Molecular Weight: 373.68
Synonyms: None
SMILES: ClC1=CC=CC(OC2=CC=3N=C(SC)N(C3C=C2Cl)C)=C1Cl
Tpsa: 27.05
Logp: 6.0477
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₁Cl₃N₂OS
Molecular Weight:
373.68
Synonyms:
None
SMILES:
ClC1=CC=CC(OC2=CC=3N=C(SC)N(C3C=C2Cl)C)=C1Cl
Tpsa:
27.05
Logp:
6.0477
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₁₈N₆O₅S₃
Molecular Weight: 506.58
Synonyms: None
SMILES: C(O)(=O)C1N2[C@@]([C@H](NC(/C(=N\OC)/C3=CSC(N)=N3)=O)C2=O)(SC=C1/C=C\C4=C(C)N=CS4)[H]
Tpsa: 160.1
Logp: 1.29112
H Acceptors: 11
H Donors: 3
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₁₈N₆O₅S₃
Molecular Weight:
506.58
Synonyms:
None
SMILES:
C(O)(=O)C1N2[C@@]([C@H](NC(/C(=N\OC)/C3=CSC(N)=N3)=O)C2=O)(SC=C1/C=C\C4=C(C)N=CS4)[H]
Tpsa:
160.1
Logp:
1.29112
H Acceptors:
11
H Donors:
3
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₁H₇₆N₂O₁₆
Molecular Weight: 853.05
Synonyms: None
SMILES: O([C@H]1[C@H](C)[C@@H](O[C@H]2[C@H](O)[C@@H](N(C)C)C[C@@H](C)O2)[C@](C)(O)C[C@@H](C)/C(=N\OCOCCOC)/[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]1CO)[C@H]3C[C@](OC)(C)[C@@H](O)[C@H](C)O3
Tpsa: 237.12
Logp: 1.182
H Acceptors: 18
H Donors: 6
Rotatable Bonds: 14
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₁H₇₆N₂O₁₆
Molecular Weight:
853.05
Synonyms:
None
SMILES:
O([C@H]1[C@H](C)[C@@H](O[C@H]2[C@H](O)[C@@H](N(C)C)C[C@@H](C)O2)[C@](C)(O)C[C@@H](C)/C(=N\OCOCCOC)/[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]1CO)[C@H]3C[C@](OC)(C)[C@@H](O)[C@H](C)O3
Tpsa:
237.12
Logp:
1.182
H Acceptors:
18
H Donors:
6
Rotatable Bonds:
14
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₁ClN₄
Molecular Weight: 174.63
Synonyms: None
SMILES: C1(C2CNCC2)=NN=CN1.Cl
Tpsa: 53.6
Logp: 0.3034
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₁ClN₄
Molecular Weight:
174.63
Synonyms:
None
SMILES:
C1(C2CNCC2)=NN=CN1.Cl
Tpsa:
53.6
Logp:
0.3034
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1