CS-0544759
3-Chloro-N-(4-cyano-1-methyl-1H-pyrazol-5-yl)benzamide
Manufacturer: ChemScene
CAS Number: 1171323-74-2
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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
C₁₂H₉ClN₄O
Molecular Weight
260.68
Synonyms
None
SMILES
CN1C(=C(C=N1)C#N)NC(=O)C2=CC(=CC=C2)Cl
Tpsa
70.71
Logp
2.19748
H Acceptors
4
H Donors
1
Rotatable Bonds
2
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SAFETY INFORMATION
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: C₁₂H₉ClN₄O
Molecular Weight: 260.68
Synonyms: None
SMILES: CN1C(=C(C=N1)C#N)NC(=O)C2=CC(=CC=C2)Cl
Tpsa: 70.71
Logp: 2.19748
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₉ClN₄O
Molecular Weight:
260.68
Synonyms:
None
SMILES:
CN1C(=C(C=N1)C#N)NC(=O)C2=CC(=CC=C2)Cl
Tpsa:
70.71
Logp:
2.19748
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₁₃NO₂
Molecular Weight: 275.30
Synonyms: 2-[(2,3-dihydro-1H-indol-1-yl)methylidene]-2,3-dihydro-1H-indene-1,3-dione
SMILES: C1CN(C2=CC=CC=C21)C=C3C(=O)C4=CC=CC=C4C3=O
Tpsa: 37.38
Logp: 3.0122
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₃NO₂
Molecular Weight:
275.30
Synonyms:
2-[(2,3-dihydro-1H-indol-1-yl)methylidene]-2,3-dihydro-1H-indene-1,3-dione
SMILES:
C1CN(C2=CC=CC=C21)C=C3C(=O)C4=CC=CC=C4C3=O
Tpsa:
37.38
Logp:
3.0122
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₁N₃O₃
Molecular Weight: 233.22
Synonyms: 1-[(1,3-benzodioxol-5-yloxy)methyl]-1H-pyrazol-4-amine
SMILES: NC1=CN(COC2=CC=C(OCO3)C3=C2)N=C1
Tpsa: 71.53
Logp: 1.2305
H Acceptors: 6
H Donors: 1
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:
C₁₁H₁₁N₃O₃
Molecular Weight:
233.22
Synonyms:
1-[(1,3-benzodioxol-5-yloxy)methyl]-1H-pyrazol-4-amine
SMILES:
NC1=CN(COC2=CC=C(OCO3)C3=C2)N=C1
Tpsa:
71.53
Logp:
1.2305
H Acceptors:
6
H Donors:
1
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: C₁₁H₁₆N₂O
Molecular Weight: 192.26
Synonyms: 3-Aminomethyl-1,5,6,7,8,9-hexahydro-cyclohepta[b]pyridin-2-one
SMILES: O=C1C(CN)=CC(CCCCC2)=C2N1
Tpsa: 58.88
Logp: 1.1025
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₆N₂O
Molecular Weight:
192.26
Synonyms:
3-Aminomethyl-1,5,6,7,8,9-hexahydro-cyclohepta[b]pyridin-2-one
SMILES:
O=C1C(CN)=CC(CCCCC2)=C2N1
Tpsa:
58.88
Logp:
1.1025
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1