Methyl 4-(((2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl)amino)-2-methoxybenzoate

HCID 22646557
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기본 정보

표준 SMILES
COC(=O)c1ccc(NC=C2C(=O)OC(C)(C)OC2=O)cc1OC
InChIKey
FLQIWMCFHBVQGR-UHFFFAOYSA-N
분자식
C16H17NO7
평균 분자량
335.31 g/mol

이름 및 식별자

우선 이름
Methyl 4-(((2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl)amino)-2-methoxybenzoate
IUPAC
methyl 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-2-methoxybenzoate

이름 및 동의어

205448-64-2Methyl 4-(((2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl)amino)-2-methoxybenzoateMFCD26395147Lenvatinib Impurity 26Benzoic acid, 4-[[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]amino]-2-methoxy-, methyl esterC16H17NO7methyl 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-2-methoxybenzoatemethyl 4-{[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]amino}-2-methoxybenzoatemethyl 4-((2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino)-2-methoxybenzoateMethyl 4-[[(2,2-Dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]amino]-2-methoxybenzoate4-[(2,2-Dimethyl-4,6-dioxo-[1,3]dioxan-5-ylidenemethyl)-amino]-2-methoxy-benzoic acid methyl esterSCHEMBL6004820
이름 더 보기
FLQIWMCFHBVQGR-UHFFFAOYSA-NAKOS030524095AC-33585DS-19436SY121982DB-308291CS-0153776C73891

데이터베이스 식별자

PubChem CID
22646557
Nikkaji
J2.661.781B

물성

구조 계산 물성

XLogP
2.3
극성 표면적
100 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
8
회전 가능 결합 수
5
무거운 원자 수
24

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