CS-0914069
2-(3-(4-(1H-pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-1- (ethylsulfonyl)azetidin-3-yl)acetonitrile hydrochloride
Manufacturer: ChemScene
CAS Number: 2402776-83-2
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₆H₁₇N₇O₂S
Molecular Weight
371.42
Synonyms
None
SMILES
N#CCC1(N2C=CC3=C(N=CN=C32)C=4C=NNC4)CN(C1)S(=O)(=O)CC
Tpsa
120.56
Logp
1.09568
H Acceptors
7
H Donors
1
Rotatable Bonds
5
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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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₇N₇O₂S
Molecular Weight: 371.42
Synonyms: None
SMILES: N#CCC1(N2C=CC3=C(N=CN=C32)C=4C=NNC4)CN(C1)S(=O)(=O)CC
Tpsa: 120.56
Logp: 1.09568
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 5
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₇N₇O₂S
Molecular Weight:
371.42
Synonyms:
None
SMILES:
N#CCC1(N2C=CC3=C(N=CN=C32)C=4C=NNC4)CN(C1)S(=O)(=O)CC
Tpsa:
120.56
Logp:
1.09568
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
5
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₂₇N₉O₄S₂
Molecular Weight: 557.65
Synonyms: None
SMILES: N#CCC1(N2N=CC(=C2)C=3N=CN=C4C3C=CN4C5(CC#N)CN(C5)S(=O)(=O)CC)CN(C1)S(=O)(=O)CC
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₂₇N₉O₄S₂
Molecular Weight:
557.65
Synonyms:
None
SMILES:
N#CCC1(N2N=CC(=C2)C=3N=CN=C4C3C=CN4C5(CC#N)CN(C5)S(=O)(=O)CC)CN(C1)S(=O)(=O)CC
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₃₆O₇
Molecular Weight: 484.58
Synonyms: None
SMILES: C(COC(CC)=O)(=O)[C@]1(OC(CC)=O)[C@]2(C)[C@@](C[C@@H]1C)(C3=C([C@@H](O)C2)[C@]4(C)C(CC3)=CC(=O)C=C4)[H]
Tpsa: 106.97
Logp: 3.7896
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₃₆O₇
Molecular Weight:
484.58
Synonyms:
None
SMILES:
C(COC(CC)=O)(=O)[C@]1(OC(CC)=O)[C@]2(C)[C@@](C[C@@H]1C)(C3=C([C@@H](O)C2)[C@]4(C)C(CC3)=CC(=O)C=C4)[H]
Tpsa:
106.97
Logp:
3.7896
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₈N₂O₃
Molecular Weight: 226.27
Synonyms: None
SMILES: [C@@H](C(N)=O)(CC)N1C(=O)[C@H](CCC)CC1=O
Tpsa: 80.47
Logp: 0.4255
H Acceptors: 3
H Donors: 1
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:
C₁₁H₁₈N₂O₃
Molecular Weight:
226.27
Synonyms:
None
SMILES:
[C@@H](C(N)=O)(CC)N1C(=O)[C@H](CCC)CC1=O
Tpsa:
80.47
Logp:
0.4255
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5