CS-0011460
1-(3-(4-Chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridin-2-yl)phenyl)-N,N-dimethylmethanamine
Manufacturer: ChemScene
CAS Number: None
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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
C₂₂H₂₀ClN₃O₂S
Molecular Weight
425.93
Synonyms
None
SMILES
ClC1=C(C=C(C2=CC(CN(C)C)=CC=C2)N3S(=O)(C4=CC=CC=C4)=O)C3=NC=C1
Tpsa
55.2
Logp
4.6553
H Acceptors
5
H Donors
0
Rotatable Bonds
5
Other Options
...
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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: C₂₂H₂₀ClN₃O₂S
Molecular Weight: 425.93
Synonyms: None
SMILES: ClC1=C(C=C(C2=CC(CN(C)C)=CC=C2)N3S(=O)(C4=CC=CC=C4)=O)C3=NC=C1
Tpsa: 55.2
Logp: 4.6553
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₀ClN₃O₂S
Molecular Weight:
425.93
Synonyms:
None
SMILES:
ClC1=C(C=C(C2=CC(CN(C)C)=CC=C2)N3S(=O)(C4=CC=CC=C4)=O)C3=NC=C1
Tpsa:
55.2
Logp:
4.6553
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₂₃NO₄
Molecular Weight: 329.39
Synonyms: None
SMILES: N[C@H]1CC2=C(C(OC)=CC=C2)CC1.O[C@@H](C(O)=O)C3=CC=CC=C3
Tpsa: 92.78
Logp: 2.3158
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₃NO₄
Molecular Weight:
329.39
Synonyms:
None
SMILES:
N[C@H]1CC2=C(C(OC)=CC=C2)CC1.O[C@@H](C(O)=O)C3=CC=CC=C3
Tpsa:
92.78
Logp:
2.3158
H Acceptors:
4
H Donors:
3
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: C₁₈H₁₇BrN₂
Molecular Weight: 341.25
Synonyms: None
SMILES: BrC1=CC=C(N=C(N(C)C)C(CC2=CC=CC=C2)=C3)C3=C1
Tpsa: 16.13
Logp: 4.6541
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:
C₁₈H₁₇BrN₂
Molecular Weight:
341.25
Synonyms:
None
SMILES:
BrC1=CC=C(N=C(N(C)C)C(CC2=CC=CC=C2)=C3)C3=C1
Tpsa:
16.13
Logp:
4.6541
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: C₂₉H₄₃BrO₃
Molecular Weight: 519.55
Synonyms: Estra-1,3,5(10)-triene-3,17-diol,7-(9-bromononyl)-,17-acetate,(7a,17b)-
SMILES: OC1=CC=C2C(C[C@@H](CCCCCCCCCBr)[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@@H]4OC(C)=O)=C1
Tpsa: 46.53
Logp: 7.9218
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₉H₄₃BrO₃
Molecular Weight:
519.55
Synonyms:
Estra-1,3,5(10)-triene-3,17-diol,7-(9-bromononyl)-,17-acetate,(7a,17b)-
SMILES:
OC1=CC=C2C(C[C@@H](CCCCCCCCCBr)[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@@H]4OC(C)=O)=C1
Tpsa:
46.53
Logp:
7.9218
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
10