CS-0832141
N-(4-Methyl-3-(N-(4-(pyridin-3-yl)pyrimidin-2-yl)acetamido)phenyl)-4-((4-methylpiperazin-1-yl)methyl)benzamide
Manufacturer: ChemScene
CAS Number: 1321600-78-5
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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
C₃₁H₃₃N₇O₂
Molecular Weight
535.64
Synonyms
None
SMILES
O=C(NC1=CC=C(C)C(N(C(C)=O)C2=NC=CC(C3=CC=CN=C3)=N2)=C1)C(C=C4)=CC=C4CN5CCN(C)CC5
Tpsa
94.56
Logp
4.53132
H Acceptors
7
H Donors
1
Rotatable Bonds
7
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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: C₃₁H₃₃N₇O₂
Molecular Weight: 535.64
Synonyms: None
SMILES: O=C(NC1=CC=C(C)C(N(C(C)=O)C2=NC=CC(C3=CC=CN=C3)=N2)=C1)C(C=C4)=CC=C4CN5CCN(C)CC5
Tpsa: 94.56
Logp: 4.53132
H Acceptors: 7
H Donors: 1
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:
C₃₁H₃₃N₇O₂
Molecular Weight:
535.64
Synonyms:
None
SMILES:
O=C(NC1=CC=C(C)C(N(C(C)=O)C2=NC=CC(C3=CC=CN=C3)=N2)=C1)C(C=C4)=CC=C4CN5CCN(C)CC5
Tpsa:
94.56
Logp:
4.53132
H Acceptors:
7
H Donors:
1
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: C₁₄H₁₁NO₂
Molecular Weight: 225.24
Synonyms: None
SMILES: O=[N+](/C=C(C1=CC=CC=C1)\C2=CC=CC=C2)[O-]
Tpsa: 43.14
Logp: 3.3525
H Acceptors: 2
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:
C₁₄H₁₁NO₂
Molecular Weight:
225.24
Synonyms:
None
SMILES:
O=[N+](/C=C(C1=CC=CC=C1)\C2=CC=CC=C2)[O-]
Tpsa:
43.14
Logp:
3.3525
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₉Cl₂NO₄
Molecular Weight: 326.13
Synonyms: None
SMILES: ClC1=CC(C(NC2=CC=C(C(O)=O)C=C2O)=O)=CC(Cl)=C1
Tpsa: 86.63
Logp: 3.6495
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₉Cl₂NO₄
Molecular Weight:
326.13
Synonyms:
None
SMILES:
ClC1=CC(C(NC2=CC=C(C(O)=O)C=C2O)=O)=CC(Cl)=C1
Tpsa:
86.63
Logp:
3.6495
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₈O₄
Molecular Weight: 204.18
Synonyms: None
SMILES: O=C(C1=CC=C2C(O)=C(O)C=CC2=C1)O
Tpsa: 77.76
Logp: 1.9492
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₈O₄
Molecular Weight:
204.18
Synonyms:
None
SMILES:
O=C(C1=CC=C2C(O)=C(O)C=CC2=C1)O
Tpsa:
77.76
Logp:
1.9492
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
1