CS-1003470
2-Propenamide, N-[2-[[2-(dimethylamino)ethyl]methylamino]-4-methoxy-5-[[4-(1-methyl-1H-indol-3-yl)-2-pyrimidinyl]amino]phenyl]-N-[3-[[2-[[2-(dimethylamino)ethyl]methylamino]-4-methoxy-5-[[4-(1-methyl-1H-indol-3-yl)-2-pyrimidinyl]amino]phenyl]amino]-3-oxopropyl]-
Manufacturer: ChemScene
CAS Number: 2919324-18-6
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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
C₅₆H₆₆N₁₄O₄
Molecular Weight
999.21
Synonyms
None
SMILES
O=C(C=C)N(C1=CC(NC=2N=CC=C(N2)C3=CN(C=4C=CC=CC34)C)=C(OC)C=C1N(C)CCN(C)C)CCC(=O)NC5=CC(NC=6N=CC=C(N6)C7=CN(C=8C=CC=CC78)C)=C(OC)C=C5N(C)CCN(C)C
Tpsa
166.31
Logp
8.6318
H Acceptors
16
H Donors
3
Rotatable Bonds
22
Other Options
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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: C₅₆H₆₆N₁₄O₄
Molecular Weight: 999.21
Synonyms: None
SMILES: O=C(C=C)N(C1=CC(NC=2N=CC=C(N2)C3=CN(C=4C=CC=CC34)C)=C(OC)C=C1N(C)CCN(C)C)CCC(=O)NC5=CC(NC=6N=CC=C(N6)C7=CN(C=8C=CC=CC78)C)=C(OC)C=C5N(C)CCN(C)C
Tpsa: 166.31
Logp: 8.6318
H Acceptors: 16
H Donors: 3
Rotatable Bonds: 22
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₆H₆₆N₁₄O₄
Molecular Weight:
999.21
Synonyms:
None
SMILES:
O=C(C=C)N(C1=CC(NC=2N=CC=C(N2)C3=CN(C=4C=CC=CC34)C)=C(OC)C=C1N(C)CCN(C)C)CCC(=O)NC5=CC(NC=6N=CC=C(N6)C7=CN(C=8C=CC=CC78)C)=C(OC)C=C5N(C)CCN(C)C
Tpsa:
166.31
Logp:
8.6318
H Acceptors:
16
H Donors:
3
Rotatable Bonds:
22
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₂₂N₄
Molecular Weight: 222.33
Synonyms: None
SMILES: N12CCN3CCN4CCN(CC1)C4(C)C23C
Tpsa: 12.96
Logp: -0.3188
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₂₂N₄
Molecular Weight:
222.33
Synonyms:
None
SMILES:
N12CCN3CCN4CCN(CC1)C4(C)C23C
Tpsa:
12.96
Logp:
-0.3188
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
0
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₂O₄
Molecular Weight: 172.18
Synonyms: None
SMILES: O=C(OCC)C=C(OC(=O)C)C
Tpsa: 52.6
Logp: 1.0164
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₂O₄
Molecular Weight:
172.18
Synonyms:
None
SMILES:
O=C(OCC)C=C(OC(=O)C)C
Tpsa:
52.6
Logp:
1.0164
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: C₉H₁₈ClI
Molecular Weight: 288.60
Synonyms: None
SMILES: ClCCCCCCCCCI
Tpsa: 0
Logp: 4.3909
H Acceptors: 0
H Donors: 0
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₈ClI
Molecular Weight:
288.60
Synonyms:
None
SMILES:
ClCCCCCCCCCI
Tpsa:
0
Logp:
4.3909
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
8